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3-Methoxy-benzoic acid cyclohexyl ester
SpectraBase Compound ID 253XH8q3IQS
InChI InChI=1S/C14H18O3/c1-16-13-9-5-6-11(10-13)14(15)17-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8H2,1H3
InChIKey WVZFRANMBKOKNR-UHFFFAOYSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkBBoV5pFrM
Name 3-Methoxy-benzoic acid cyclohexyl ester
Classification Pharmaceutical drug precursor
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 234.125594437 u
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-16-13-9-5-6-11(10-13)14(15)17-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8H2,1H3
InChIKey WVZFRANMBKOKNR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 234.295 g/mol
Nominal Mass 234 u
Quality 999
Retention Index 1900
SMILES C=1(C(OC2CCCCC2)=O)C=C(C=CC1)OC
SPLASH splash10-0udi-4900000000-ac6f3cf8e2a853bbdc52
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms m-Anisic acid cyclohexyl ester Cyclohexyl-m-methoxybenzoate
Technique GC/MS
Wiley ID DD2024_022282