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(.alpha.R,3S)-1-Benzoyl-3-N,N-dimethylcarbamoyl-2-.alpha.-methylbenzylaminocyclohexene
SpectraBase Compound ID JNHnSIdxi1A
InChI InChI=1S/C24H28N2O2/c1-17(18-11-6-4-7-12-18)25-22-20(23(27)19-13-8-5-9-14-19)15-10-16-21(22)24(28)26(2)3/h4-9,11-14,17,21,25H,10,15-16H2,1-3H3/t17-,21+/m1/s1
InChIKey FIFHGRVLAHIXRB-UTKZUKDTSA-N
Mol Weight 376.5 g/mol
Molecular Formula C24H28N2O2
Exact Mass 376.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Q57qnsbzdi
Name (.alpha.R,3S)-1-Benzoyl-3-N,N-dimethylcarbamoyl-2-.alpha.-methylbenzylaminocyclohexene
Alternate Name(s) (1S)-3-benzoyl-N,N-dimethyl-2-{[(1R)-1-phenylethyl]amino}-2-cyclohexene-1-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28N2O2
InChI InChI=1S/C24H28N2O2/c1-17(18-11-6-4-7-12-18)25-22-20(23(27)19-13-8-5-9-14-19)15-10-16-21(22)24(28)26(2)3/h4-9,11-14,17,21,25H,10,15-16H2,1-3H3/t17-,21+/m1/s1
InChIKey FIFHGRVLAHIXRB-UTKZUKDTSA-N
Molecular Weight 376.500 g/mol
SMILES N(C1=C(C(=O)c2ccccc2)CCC[C@@]1(C(N(C)C)=O)[H])[C@@](c1ccccc1)(C)[H]
SPLASH splash10-0ak9-0590000000-d9e7aaeb73d63c3e80d6
Source of Spectrum F-53-6900-2
Wiley ID 802068