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(3R,5S)-3-(N-Benzyl-N-tosylamino)-5-isopropenyl-2-methylcyclohexene
SpectraBase Compound ID AKQcjsO1qpo
InChI InChI=1S/C24H29NO2S/c1-18(2)22-13-12-20(4)24(16-22)25(17-21-8-6-5-7-9-21)28(26,27)23-14-10-19(3)11-15-23/h5-12,14-15,22,24H,1,13,16-17H2,2-4H3/t22-,24+/m0/s1
InChIKey URBLEYKIXUNTDQ-LADGPHEKSA-N
Mol Weight 395.56 g/mol
Molecular Formula C24H29NO2S
Exact Mass 395.1919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7OcsYOVQrzB
Name (3R,5S)-3-(N-Benzyl-N-tosylamino)-5-isopropenyl-2-methylcyclohexene
Alternate Name(s) N-benzyl-N-[(1R,5S)-5-isopropenyl-2-methyl-2-cyclohexen-1-yl]-4-methylbenzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H29NO2S
InChI InChI=1S/C24H29NO2S/c1-18(2)22-13-12-20(4)24(16-22)25(17-21-8-6-5-7-9-21)28(26,27)23-14-10-19(3)11-15-23/h5-12,14-15,22,24H,1,13,16-17H2,2-4H3/t22-,24+/m0/s1
InChIKey URBLEYKIXUNTDQ-LADGPHEKSA-N
Molecular Weight 395.561 g/mol
SMILES [C@]1(N(S(c2ccc(cc2)C)(=O)=O)Cc2ccccc2)(C[C@@](C(=C)C)(CC=C1C)[H])[H]
SPLASH splash10-0006-9220000000-924b952fb549d43bc581
Source of Spectrum J-59-5639-21
Wiley ID 1367121