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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 DjjklyTJ1hQ
Name cis-3-Hexen-1-ol-butanoate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 170.130679818 u
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
Ionization Type Electron Ionization (EI)
Molecular Weight 170.252 g/mol
Nominal Mass 170 u
Quality 1000
Retention Index 1178
SMILES C(OCC\C=C/CC)(CCC)=O
SPLASH splash10-01c3-9000000000-221b911e004c640581f1
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_027344