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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H18O2
Molecular Weight 158.238
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOAMYL BUTYRATE

SMILES

CCCC(=O)OCCC(C)C

InChI

InChIKey=PQLMXFQTAMDXIZ-UHFFFAOYSA-N
InChI=1S/C9H18O2/c1-4-5-9(10)11-7-6-8(2)3/h8H,4-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C9H18O2
Molecular Weight 158.238
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Effect of wild strains of Lactococcus lactis on the volatile profile and the sensory characteristics of ewes' raw milk cheese.
2002 Dec
A new potential attractant for Anastrepha obliqua from Spondias mombin fruits.
2006 Feb
Field evaluation of potential fruit-derived lures for Anastrepha obliqua (Diptera: Tephritidae).
2009 Dec
Comparative analysis of the volatile fraction from Annona cherimola Mill. cultivars by solid-phase microextraction and gas chromatography-quadrupole mass spectrometry detection.
2009 Jan 15
6,8-Di-C-glycosyl flavonoids from Dendrobium huoshanense.
2010 Feb 26
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:17:42 GMT 2023
Edited
by admin
on Fri Dec 15 17:17:42 GMT 2023
Record UNII
505AFM77VU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOAMYL BUTYRATE
FCC   FHFI   MI  
Systematic Name English
BUTYRIC ACID, ISOPENTYL ESTER
Common Name English
ISOAMYL BUTYRATE [FHFI]
Common Name English
BUTANOIC ACID 3-METHYLBUTYL ESTER
Systematic Name English
ISOPENTYL ALCOHOL, BUTYRATE
Systematic Name English
NSC-6548
Code English
ISOPENTYL BUTYRATE
Systematic Name English
FEMA NO. 2060
Code English
ISOAMYL BUTYRATE [MI]
Common Name English
ISOAMYL BUTYRATE [FCC]
Common Name English
3-METHYL-1-BUTYL BUTANOATE
Systematic Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
JECFA EVALUATION ISOAMYL BUTYRATE
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
Code System Code Type Description
ECHA (EC/EINECS)
203-380-8
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY
FDA UNII
505AFM77VU
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY
SMS_ID
100000135278
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY
EPA CompTox
DTXSID3042059
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY
NSC
6548
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY
JECFA MONOGRAPH
294
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY
CAS
106-27-4
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY
RXCUI
1314272
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY RxNorm
CHEBI
87422
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY
PUBCHEM
7795
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY
EVMPD
SUB70210
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY
MERCK INDEX
m6430
Created by admin on Fri Dec 15 17:17:42 GMT 2023 , Edited by admin on Fri Dec 15 17:17:42 GMT 2023
PRIMARY Merck Index