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1-((2R,3S)-3-Cyclohex-1-enyl-2-methyl-3-phenylsulfanyl-propyl)-3-phenyl-urea
SpectraBase Compound ID 17SHTw0KvSX
InChI InChI=1S/C23H28N2OS/c1-18(17-24-23(26)25-20-13-7-3-8-14-20)22(19-11-5-2-6-12-19)27-21-15-9-4-10-16-21/h3-4,7-11,13-16,18,22H,2,5-6,12,17H2,1H3,(H2,24,25,26)/t18-,22+/m1/s1
InChIKey GQZHHWGCQYBUNR-GCJKJVERSA-N
Mol Weight 380.55 g/mol
Molecular Formula C23H28N2OS
Exact Mass 380.192235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bk2UcyPtzgo
Name 1-((2R,3S)-3-Cyclohex-1-enyl-2-methyl-3-phenylsulfanyl-propyl)-3-phenyl-urea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28N2OS
InChI InChI=1S/C23H28N2OS/c1-18(17-24-23(26)25-20-13-7-3-8-14-20)22(19-11-5-2-6-12-19)27-21-15-9-4-10-16-21/h3-4,7-11,13-16,18,22H,2,5-6,12,17H2,1H3,(H2,24,25,26)/t18-,22+/m1/s1
InChIKey GQZHHWGCQYBUNR-GCJKJVERSA-N
Molecular Weight 380.550 g/mol
SMILES N(C(NC[C@]([C@@](C1=CCCCC1)(Sc1ccccc1)[H])(C)[H])=O)c1ccccc1
SPLASH splash10-00dl-5090000000-b6e59eed7cc5f5fbdfd7
Source of Spectrum KC-1993-1648-32
Synonyms N-[(2R,3S)-3-(1-cyclohexen-1-yl)-2-methyl-3-(phenylsulfanyl)propyl]-N'-phenylurea syn-(2RS,3SR)-N-(3-Phenylthio-3-cyclohexenyl-2-methylpropyl)-N-phenylurea
Wiley ID 778332