U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C6H12O2
Molecular Weight 116.1583
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL ISOBUTYRATE

SMILES

CCOC(=O)C(C)C

InChI

InChIKey=WDAXFOBOLVPGLV-UHFFFAOYSA-N
InChI=1S/C6H12O2/c1-4-8-6(7)5(2)3/h5H,4H2,1-3H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Assay of aroma active components of virgin olive oils from southern Italian regions by SPME-GC/ion trap mass spectrometry.
2003 Jan 29
Aroma extract dilution analysis of Cv. Marion (Rubus spp. hyb) and Cv. Evergreen (R. laciniatus L.) blackberries.
2003 May 21
Aroma extract dilution analysis of cv. Meeker (Rubus idaeus L.) red raspberries from Oregon and Washington.
2004 Aug 11
Odor-active constituents in fresh pineapple (Ananas comosus [L.] Merr.) by quantitative and sensory evaluation.
2005 Jul
Identification based on quantitative measurements and aroma recombination of the character impact odorants in a Bavarian Pilsner-type beer.
2005 Sep 21
Recyclable polymeric pi-acid catalyst effective on Mannich-type reaction in water.
2006 Apr
Comparison of the odor-active compounds in unhopped beer and beers hopped with different hop varieties.
2006 Nov 15
Characterization of the key aroma compounds in soy sauce using approaches of molecular sensory science.
2007 Jul 25
Characterization of the key aroma compounds in an american bourbon whisky by quantitative measurements, aroma recombination, and omission studies.
2008 Jul 23
Characterization of volatile compounds contributing to naturally occurring fruity fermented flavor in peanuts.
2008 Sep 10
Defining the typical aroma of sherry vinegar: sensory and chemical approach.
2008 Sep 10
Metabolomics reveals alterations in both primary and secondary metabolites by wine bacteria.
2009 Nov 25
Identification of odor impact compounds of Tagetes minuta L. essential oil: comparison of two GC-olfactometry methods.
2009 Sep 23
Volatile profiling reveals intracellular metabolic changes in Aspergillus parasiticus: veA regulates branched chain amino acid and ethanol metabolism.
2010 Aug 24
Branched-chain and aromatic amino acid catabolism into aroma volatiles in Cucumis melo L. fruit.
2010 Feb
Evaluation of the active odorants in Amontillado sherry wines during the aging process.
2010 Jun 9
Patents
Name Type Language
ETHYL ISOBUTYRATE
FCC   FHFI   MI  
Systematic Name English
ETHYL ISOBUTYRATE [MI]
Common Name English
ETHYL ISOBUTYRATE [FHFI]
Common Name English
ISO BUTYRIC ACID ETHYL ESTER
Systematic Name English
FEMA NO. 2428
Code English
ETHYL 2-METHYLPROPANOATE
Systematic Name English
PROPANOIC ACID, 2-METHYL-, ETHYL ESTER
Common Name English
NSC-97194
Code English
ETHYL ISOBUTYRATE [FCC]
Common Name English
Classification Tree Code System Code
JECFA EVALUATION ETHYL ISOBUTYRATE
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
Code System Code Type Description
PUBCHEM
7342
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
CHEBI
87303
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
MESH
C546702
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
JECFA MONOGRAPH
214
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
EVMPD
SUB91404
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
FDA UNII
9A9661LN4H
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-595-4
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
MERCK INDEX
m5139
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID7047728
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
CAS
97-62-1
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
SMS_ID
100000141276
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY
NSC
97194
Created by admin on Fri Dec 15 17:36:42 GMT 2023 , Edited by admin on Fri Dec 15 17:36:42 GMT 2023
PRIMARY