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n-Hexyl-cis-hexen-2-oate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

n-Hexyl-cis-hexen-2-oate
SpectraBase Compound ID ARXHbsS0sXA
InChI InChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h8,10H,3-7,9,11H2,1-2H3/b10-8-
InChIKey NGQTTWDHJIMWOI-NTMALXAHSA-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 AwJSWhrWwlk
Name n-Hexyl-cis-hexen-2-oate
CAS Registry Number 33855-56-0
Copyright Copyright © 2020-2025 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/h8,10H,3-7,9,11H2,1-2H3/b10-8-
InChIKey NGQTTWDHJIMWOI-NTMALXAHSA-N
Molecular Weight 198.306 g/mol
SMILES C(\C=C/CCC)(=O)OCCCCCC
SPLASH splash10-052f-9100000000-7e26e5ae29ba0239916e
Source of Spectrum MS-0-1228-21
Synonyms Hexyl (2Z)-2-hexenoate
Wiley ID 1195761