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(3Z)-3-Hexenyl butyrate
SpectraBase Compound ID KxypqGby695
InChI InChI=1S/C10H18O2/c1-3-5-6-7-9-12-10(11)8-4-2/h5-6H,3-4,7-9H2,1-2H3/b6-5-
InChIKey ZCHOPXVYTWUHDS-WAYWQWQTSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xBUuwEr44
Name (3Z)-3-Hexenyl butyrate
Alternate Name(s) Butanoic acid, 3-hexenyl ester, (Z)- (Z)-3-Hexenyl butyrate (Z)-Hex-3-enyl butyrate 3-Hexenyl butanoate, (Z)- Butyric acid, 3-hexenyl ester, (Z)- 3-Hexenyl butanoate, cis- 3-Hexenyl butyrate 3-Hexenyl butyrate, (Z)- 3-Hexenyl butyrate, cis- beta,gamma-hexenyl butyrate Butanoic acid, (3Z)-3-hexenyl ester cis-3-Hexen-1-yl butyrate cis-3-Hexenyl butanoate cis-3-Hexenyl butyrate cis-Butyric acid, 3-hexenyl ester cis-Hex-3-enyl butyrate Butanoic acid [(Z)-hex-3-enyl] ester [(Z)-hex-3-enyl] butanoate AI3-33202 EINECS 240-553-7 FEMA NO. 3402
CAS Registry Number 16491-36-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-3-5-6-7-9-12-10(11)8-4-2/h5-6H,3-4,7-9H2,1-2H3/b6-5-
InChIKey ZCHOPXVYTWUHDS-WAYWQWQTSA-N
Molecular Weight 170.252 g/mol
SMILES C(=O)(OCC\C=C/CC)CCC
SPLASH splash10-00rx-9000000000-1b6c7f74c9da4a6bfb44
Source of Spectrum XW-210-0-0
Wiley ID 1166863