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anti-(2RS,3RS)-N-Ethyl-N'-[2-methyl-3-(phenylthio)-3-cyclohexenylpropyl]urea
SpectraBase Compound ID Fo1Kqw9Cxum
InChI InChI=1S/C19H28N2OS/c1-3-20-19(22)21-14-15(2)18(16-10-6-4-7-11-16)23-17-12-8-5-9-13-17/h5,8-10,12-13,15,18H,3-4,6-7,11,14H2,1-2H3,(H2,20,21,22)/t15-,18-/m1/s1
InChIKey ROYMNYSGZYGCSB-CRAIPNDOSA-N
Mol Weight 332.51 g/mol
Molecular Formula C19H28N2OS
Exact Mass 332.192235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HSGSxcON9Nw
Name anti-(2RS,3RS)-N-Ethyl-N'-[2-methyl-3-(phenylthio)-3-cyclohexenylpropyl]urea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28N2OS
InChI InChI=1S/C19H28N2OS/c1-3-20-19(22)21-14-15(2)18(16-10-6-4-7-11-16)23-17-12-8-5-9-13-17/h5,8-10,12-13,15,18H,3-4,6-7,11,14H2,1-2H3,(H2,20,21,22)/t15-,18-/m1/s1
InChIKey ROYMNYSGZYGCSB-CRAIPNDOSA-N
Molecular Weight 332.506 g/mol
SMILES N(C(=O)NCC)C[C@]([C@](C1=CCCCC1)(Sc1ccccc1)[H])(C)[H]
SPLASH splash10-00di-0390000000-55d91b7fde23b70ee869
Source of Spectrum KC-1993-1647-28
Synonyms N-[(2R,3R)-3-(1-cyclohexen-1-yl)-2-methyl-3-(phenylsulfanyl)propyl]-N'-ethylurea
Wiley ID 778341