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2,4-Pentadien-1-ol, 3-methyl-5-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-, benzoate, (E,E)-(.+-.)-
SpectraBase Compound ID KKv0cPooLMH
InChI InChI=1S/C22H28O3/c1-17(12-16-24-19(23)18-9-6-5-7-10-18)11-15-22-20(2,3)13-8-14-21(22,4)25-22/h5-7,9-12,15H,8,13-14,16H2,1-4H3/b15-11+,17-12+
InChIKey OYKUGXDHJZLRDP-SSZXNVRRSA-N
Mol Weight 340.46 g/mol
Molecular Formula C22H28O3
Exact Mass 340.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID NEw9cv0jjf
Name 2,4-Pentadien-1-ol, 3-methyl-5-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-, benzoate, (E,E)-(.+-.)-
Alternate Name(s) (+-)[(2E,4E)-3-Methyl-5-(2',2',6'-trimethyl-7'-oxabicyclo[4.1.0]hept-1'-yl)-2,4-pentadien-1-yl]ester of benzoic acid (2E,4E)-3-methyl-5-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-2,4-pentadienyl benzoate 7-Oxabicyclo[4.1.0]heptane, 2,4-pentadien-1-ol deriv.
CAS Registry Number 90394-76-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O3
InChI InChI=1S/C22H28O3/c1-17(12-16-24-19(23)18-9-6-5-7-10-18)11-15-22-20(2,3)13-8-14-21(22,4)25-22/h5-7,9-12,15H,8,13-14,16H2,1-4H3/b15-11+,17-12+
InChIKey OYKUGXDHJZLRDP-SSZXNVRRSA-N
Molecular Weight 340.463 g/mol
SMILES C12(OC2(CCCC1(C)C)C)\C=C\C(=C\COC(=O)c1ccccc1)C
SPLASH splash10-0a4l-6910000000-128078535c2520259dc4
Source of Spectrum H-67-182-0
Wiley ID 1335548