ETHYL ISOBUTYRATE

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 Search

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

Molecular Formula	C6H12O2
Molecular Weight	116.1583
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Chemical and sensorial aroma characterization of freshly distilled Calvados. 2. Identification of volatile compounds and key odorants.	2003 Jan 15	12517107
Assay of aroma active components of virgin olive oils from southern Italian regions by SPME-GC/ion trap mass spectrometry.	2003 Jan 29	12537450
Aroma extract dilution analysis of Cv. Marion (Rubus spp. hyb) and Cv. Evergreen (R. laciniatus L.) blackberries.	2003 May 21	12744680
Aroma extract dilution analysis of cv. Meeker (Rubus idaeus L.) red raspberries from Oregon and Washington.	2004 Aug 11	15291490
Odor-active constituents in fresh pineapple (Ananas comosus [L.] Merr.) by quantitative and sensory evaluation.	2005 Jul	16041138
Identification based on quantitative measurements and aroma recombination of the character impact odorants in a Bavarian Pilsner-type beer.	2005 Sep 21	16159184
Recyclable polymeric pi-acid catalyst effective on Mannich-type reaction in water.	2006 Apr	16595974
Quantification of selected aroma-active compounds in Pinot noir wines from different grape maturities.	2006 Nov 1	17061835
Comparison of the odor-active compounds in unhopped beer and beers hopped with different hop varieties.	2006 Nov 15	17090134
Characterization of the key aroma compounds in soy sauce using approaches of molecular sensory science.	2007 Jul 25	17602655
Correlating volatile compounds, sensory attributes, and quality parameters in stored fresh-cut cantaloupe.	2007 Nov 14	17944532
Characterization of the key aroma compounds in an american bourbon whisky by quantitative measurements, aroma recombination, and omission studies.	2008 Jul 23	18582086
Characterization of volatile compounds contributing to naturally occurring fruity fermented flavor in peanuts.	2008 Sep 10	18686969
Defining the typical aroma of sherry vinegar: sensory and chemical approach.	2008 Sep 10	18651741
Nitrogen addition influences formation of aroma compounds, volatile acidity and ethanol in nitrogen deficient media fermented by Saccharomyces cerevisiae wine strains.	2009 Aug	19619854
Examples of perceptive interactions involved in specific "red-" and "black-berry" aromas in red wines.	2009 May 13	19326950
Metabolomics reveals alterations in both primary and secondary metabolites by wine bacteria.	2009 Nov 25	19919120
Identification of odor impact compounds of Tagetes minuta L. essential oil: comparison of two GC-olfactometry methods.	2009 Sep 23	19694437
Volatile profiling reveals intracellular metabolic changes in Aspergillus parasiticus: veA regulates branched chain amino acid and ethanol metabolism.	2010 Aug 24	20735852
Branched-chain and aromatic amino acid catabolism into aroma volatiles in Cucumis melo L. fruit.	2010 Feb	20065117
Evaluation of the active odorants in Amontillado sherry wines during the aging process.	2010 Jun 9	20465212

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:36:42 GMT 2023` Edited by `admin` on `Fri Dec 15 17:36:42 GMT 2023`
Record UNII	9A9661LN4H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETHYL ISOBUTYRATE

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