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cis-3-Hexenyl hexanoate

View entire compound with spectra: 4 NMR, 4 FTIR, 1 Raman, and 13 MS (GC)

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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1N9mfjiaEAq
Name cis-3-HEXEN-1-OL, HEXANOATE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 31501-11-8
Copyright Copyright © 1980, 1981-2024 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/h5,7H,3-4,6,8-11H2,1-2H3/b7-5-
InChIKey RGACQXBDYBCJCY-ALCCZGGFSA-N
Molecular Weight 198.31
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 3-HEXEN-1-OL, HEXANOATE, cis-,