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3-Cyclohexene-1-carboxylic acid, 2-(3,4-dimethoxyphenyl)-, methyl ester, cis-
SpectraBase Compound ID 2HfWJ0wgmzt
InChI InChI=1S/C16H20O4/c1-18-14-9-8-11(10-15(14)19-2)12-6-4-5-7-13(12)16(17)20-3/h4,6,8-10,12-13H,5,7H2,1-3H3/t12-,13-/m1/s1
InChIKey RAPSKBDUOCEMHT-CHWSQXEVSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IMsZF4TfuGn
Name 3-Cyclohexene-1-carboxylic acid, 2-(3,4-dimethoxyphenyl)-, methyl ester, cis-
Alternate Name(s) Methyl (1R,2S)-2-(3,4-dimethoxyphenyl)-3-cyclohexene-1-carboxylate Methyl cis-2-(3',4'-dimethoxyphenyl)cyclohex-3-ene-1-carboxylate
CAS Registry Number 75560-77-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-18-14-9-8-11(10-15(14)19-2)12-6-4-5-7-13(12)16(17)20-3/h4,6,8-10,12-13H,5,7H2,1-3H3/t12-,13-/m1/s1
InChIKey RAPSKBDUOCEMHT-CHWSQXEVSA-N
Molecular Weight 276.332 g/mol
SMILES [C@]1(c2cc(OC)c(cc2)OC)([C@](C(=O)OC)(CCC=C1)[H])[H]
SPLASH splash10-00ou-0390000000-a4dfedad708a770054cf
Source of Spectrum B-33-916-0
Wiley ID 1280139