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cis-3-Hexenyl  hexanoate
SpectraBase Compound ID 8w7nDzaCDYj
InChI InChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h5,7H,3-4,6,8-11H2,1-2H3/b7-5-
InChIKey RGACQXBDYBCJCY-ALCCZGGFSA-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 E6Q16oP5kA1
Name HEXANOIC ACID, 3-HEXENYL ESTER, (Z)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Exact Mass 198.161979946 u
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h5,7H,3-4,6,8-11H2,1-2H3/b7-5-
InChIKey RGACQXBDYBCJCY-ALCCZGGFSA-N
Molecular Weight 198.306 g/mol
Nominal Mass 198 u
Number of Peaks 86
SMILES C(CCCCC)(OCC\C=C/CC)=O
SPLASH splash10-00l6-9000000000-3e9cf5e5481d9d5cb71b
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX_000521