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(4E)-4-Hexenyl hexanoate

View entire compound with spectra: 2 MS (GC)

(4E)-4-Hexenyl hexanoate
SpectraBase Compound ID CxGDSa4JzXq
InChI InChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h3,5H,4,6-11H2,1-2H3/b5-3+
InChIKey DYOGMCCRMUFRSF-HWKANZROSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XhW6DhoNBO
Name (4E)-4-Hexenyl hexanoate
CAS Registry Number 88552-98-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h3,5H,4,6-11H2,1-2H3/b5-3+
InChIKey DYOGMCCRMUFRSF-HWKANZROSA-N
Molecular Weight 198.306 g/mol
SMILES CCCCCC(=O)OCCC\C=C\C
SPLASH splash10-015c-9000000000-d33796f8105e0b5c75aa
Synonyms Hexanoic acid, 4-hexen-1-yl ester [(E)-hex-4-enyl] hexanoate
Wiley ID 1495557