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S-[3-(1-Hydroxycylohexyl)cyclohex-1-enyl] N-isopropylmonothiocarbamate
SpectraBase Compound ID 1kZ9k8Xht11
InChI InChI=1S/C16H27NO2S/c1-12(2)17-15(18)20-14-8-6-7-13(11-14)16(19)9-4-3-5-10-16/h11-13,19H,3-10H2,1-2H3,(H,17,18)
InChIKey LZGHNYYXWYUBRR-UHFFFAOYSA-N
Mol Weight 297.46 g/mol
Molecular Formula C16H27NO2S
Exact Mass 297.17625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FZfA7xbP7mr
Name S-[3-(1-Hydroxycylohexyl)cyclohex-1-enyl] N-isopropylmonothiocarbamate
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Formula C16H27NO2S
InChI InChI=1S/C16H27NO2S/c1-12(2)17-15(18)20-14-8-6-7-13(11-14)16(19)9-4-3-5-10-16/h11-13,19H,3-10H2,1-2H3,(H,17,18)
InChIKey LZGHNYYXWYUBRR-UHFFFAOYSA-N
Molecular Weight 297.457 g/mol
SMILES OC1(C2C=C(SC(NC(C)C)=O)CCC2)CCCCC1
SPLASH splash10-003s-9300000000-d10307dad14507a5231f
Source of Spectrum U1-2002-2985-21
Synonyms N-propan-2-ylcarbamothioic acid S-[[3-(1-hydroxycyclohexyl)-1-cyclohexenyl]] ester S-[3-(1-hydroxycyclohexyl)cyclohexen-1-yl] N-propan-2-ylcarbamothioate S-[3-(1-hydroxycyclohexyl)cyclohexen-1-yl] N-isopropylcarbamothioate S-[3-(1-oxidanylcyclohexyl)cyclohexen-1-yl] N-propan-2-ylcarbamothioate
Wiley ID 1523014