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syn-(2RS,3SR)-N-(Ethoxycarbonyl)-N-[2-methyl-3-(phenylthio)-3-cyclohexenyl]propyl-amine
SpectraBase Compound ID 3tnXTQ0zUZ4
InChI InChI=1S/C19H27NO2S/c1-3-22-19(21)20-14-15(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,(H,20,21)/t15-,18+/m1/s1
InChIKey YUWXXFIRFMWCFN-QAPCUYQASA-N
Mol Weight 333.49 g/mol
Molecular Formula C19H27NO2S
Exact Mass 333.17625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CUhdthSdptn
Name syn-(2RS,3SR)-N-(Ethoxycarbonyl)-N-[2-methyl-3-(phenylthio)-3-cyclohexenyl]propyl-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27NO2S
InChI InChI=1S/C19H27NO2S/c1-3-22-19(21)20-14-15(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,(H,20,21)/t15-,18+/m1/s1
InChIKey YUWXXFIRFMWCFN-QAPCUYQASA-N
Molecular Weight 333.490 g/mol
SMILES N(C(=O)OCC)C[C@]([C@@](C1=CCCCC1)(Sc1ccccc1)[H])(C)[H]
SPLASH splash10-0uk9-0941000000-a62249839613ad39ee99
Source of Spectrum KC-1993-1650-38
Synonyms Ethyl 3-(1-cyclohexen-1-yl)-2-methyl-3-(phenylsulfanyl)propylcarbamate
Wiley ID 778321