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3-Cyclohexene-1-carboxaldehyde, 2-(3,4-dimethoxyphenyl)-, trans-
SpectraBase Compound ID 5RjwcklNvBS
InChI InChI=1S/C15H18O3/c1-17-14-8-7-11(9-15(14)18-2)13-6-4-3-5-12(13)10-16/h4,6-10,12-13H,3,5H2,1-2H3/t12-,13-/m0/s1
InChIKey QWCALHMDIMVCJS-STQMWFEESA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7SRBbNaEPQe
Name 3-Cyclohexene-1-carboxaldehyde, 2-(3,4-dimethoxyphenyl)-, trans-
Alternate Name(s) (1R,2R)-2-(3,4-dimethoxyphenyl)-3-cyclohexene-1-carbaldehyde trans-2-(3',4'-dimethoxyphenyl)cyclohex-3-ene-1-carbaldehyde (1R,2R)-2-(3,4-dimethoxyphenyl)-1-cyclohex-3-enecarboxaldehyde
CAS Registry Number 75560-76-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-17-14-8-7-11(9-15(14)18-2)13-6-4-3-5-12(13)10-16/h4,6-10,12-13H,3,5H2,1-2H3/t12-,13-/m0/s1
InChIKey QWCALHMDIMVCJS-STQMWFEESA-N
Molecular Weight 246.306 g/mol
SMILES c1([C@@]2(C=CCC[C@]2(C=O)[H])[H])cc(OC)c(cc1)OC
SPLASH splash10-052b-0890000000-d7a2c84386106003a5f2
Source of Spectrum B-33-916-0
Wiley ID 1249153