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N-phenyl-S-[1'-(t-Butyl)allyl]-3-(2''-isopropyl-5"-methylcyclohexyl)-.alpha.-thiocarbamate
SpectraBase Compound ID B46WtJsiCWo
InChI InChI=1S/C24H37NOS/c1-17(2)21-14-12-18(3)16-19(21)13-15-22(24(4,5)6)27-23(26)25-20-10-8-7-9-11-20/h7-11,13,15,17-19,21-22H,12,14,16H2,1-6H3,(H,25,26)/b15-13+/t18-,19-,21+,22?/m1/s1
InChIKey GBORTHIFPLIGTA-MKPJPAMCSA-N
Mol Weight 387.6 g/mol
Molecular Formula C24H37NOS
Exact Mass 387.259586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5TmYPahPKf
Name N-phenyl-S-[1'-(t-Butyl)allyl]-3-(2''-isopropyl-5"-methylcyclohexyl)-.alpha.-thiocarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H37NOS
InChI InChI=1S/C24H37NOS/c1-17(2)21-14-12-18(3)16-19(21)13-15-22(24(4,5)6)27-23(26)25-20-10-8-7-9-11-20/h7-11,13,15,17-19,21-22H,12,14,16H2,1-6H3,(H,25,26)/b15-13+/t18-,19-,21+,22?/m1/s1
InChIKey GBORTHIFPLIGTA-MKPJPAMCSA-N
Molecular Weight 387.626 g/mol
SMILES N(C(SC(\C=C\[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])C(C)(C)C)=O)c1ccccc1
SPLASH splash10-002b-9602000000-65249a26651a6ea12a24
Source of Spectrum I-85-613-21
Synonyms S-allyl-thiocarbamate S-[(2E)-1-tert-butyl-3-(2-isopropyl-5-methylcyclohexyl)-2-propenyl]phenylthiocarbamate S-[1'-(t-Butyl)allyl]-3-(2''-isopropyl-5''-methylcyclohexyl)-.alpha.-thiocarbamate
Wiley ID 1584889