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phenyl 2-[(dimethylamino)methyl]-1-isopentylcyclohexane-1-carboxylate
SpectraBase Compound ID 7mzMsjvpthA
InChI InChI=1S/C21H33NO2/c1-17(2)13-15-21(14-9-8-10-18(21)16-22(3)4)20(23)24-19-11-6-5-7-12-19/h5-7,11-12,17-18H,8-10,13-16H2,1-4H3
InChIKey HEHNXDWCUXQOEZ-UHFFFAOYSA-N
Mol Weight 331.5 g/mol
Molecular Formula C21H33NO2
Exact Mass 331.251129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0tHIp4xXey
Name phenyl 2-[(dimethylamino)methyl]-1-isopentylcyclohexane-1-carboxylate
Alternate Name(s) phenyl 2-[(dimethylamino)methyl]-1-isopentylcyclohexanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H33NO2
InChI InChI=1S/C21H33NO2/c1-17(2)13-15-21(14-9-8-10-18(21)16-22(3)4)20(23)24-19-11-6-5-7-12-19/h5-7,11-12,17-18H,8-10,13-16H2,1-4H3
InChIKey HEHNXDWCUXQOEZ-UHFFFAOYSA-N
Molecular Weight 331.500 g/mol
SMILES C(C1(C(CN(C)C)CCCC1)CCC(C)C)(Oc1ccccc1)=O
SPLASH splash10-0a4i-9100000000-697eb3107f8b08bccd72
Source of Spectrum M-34-303-0
Wiley ID 1328866