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N-(1R,2S,5S,6S)-3-(hydroxymethyl)-5-methyl-2,6-diphenylcyclohexyl-acetamide
SpectraBase Compound ID EIvbcBiabwb
InChI InChI=1S/C24H27NO3/c1-16-14-21(15-28-18(3)27)23(20-12-8-5-9-13-20)24(25-17(2)26)22(16)19-10-6-4-7-11-19/h4-14,16,22-24H,15H2,1-3H3,(H,25,26)/t16-,22-,23+,24+/m0/s1
InChIKey LLHGKSQDSGQHSK-LAWCQYHFSA-N
Mol Weight 377.48 g/mol
Molecular Formula C24H27NO3
Exact Mass 377.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERk1vVI9Zgd
Name N-(1R,2S,5S,6S)-3-(hydroxymethyl)-5-methyl-2,6-diphenylcyclohexyl-acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27NO3
InChI InChI=1S/C24H27NO3/c1-16-14-21(15-28-18(3)27)23(20-12-8-5-9-13-20)24(25-17(2)26)22(16)19-10-6-4-7-11-19/h4-14,16,22-24H,15H2,1-3H3,(H,25,26)/t16-,22-,23+,24+/m0/s1
InChIKey LLHGKSQDSGQHSK-LAWCQYHFSA-N
Literature Reference DOI 10.1002/adsc.200700396
Molecular Weight 377.484 g/mol
SMILES N([C@@]1([C@](c2ccccc2)([C@@](C)(C=C(COC(C)=O)[C@]1(c1ccccc1)[H])[H])[H])[H])C(C)=O
SPLASH splash10-03xr-0390000000-67af7b95ac967928b03d
Source of Spectrum ASC-350-267/SM17-20
Synonyms ((1'S,2'R,3'R,6'S)-2'-acetamido-6'-methyl-1',2',3',6'-tetrahydro-[1,1':3',1''-terphenyl]-4'-yl)methyl acetate
Wiley ID 1765995