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O-{4'-[3",4"-(Methenedioxy)benzylcarbonyl)-3'-hydroxyphenyl]-dimethyl-thiocarbamate
SpectraBase Compound ID 3WvJ8kda9bE
InChI InChI=1S/C18H17NO5S/c1-19(2)18(22)25-12-4-5-13(15(21)9-12)14(20)7-11-3-6-16-17(8-11)24-10-23-16/h3-6,8-9,21H,7,10H2,1-2H3
InChIKey MARPVNGCODMIHY-UHFFFAOYSA-N
Mol Weight 359.4 g/mol
Molecular Formula C18H17NO5S
Exact Mass 359.082744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KtZIJfLN5bZ
Name O-{4'-[3",4"-(Methenedioxy)benzylcarbonyl)-3'-hydroxyphenyl]-dimethyl-thiocarbamate
Alternate Name(s) O-{4'-[3'',4''-(Methenedioxy)benzylcarbonyl)-3'-hydroxyphenyl]-dimethyl-thiocarbamate N,N-dimethylcarbamothioic acid S-[4-[2-(1,3-benzodioxol-5-yl)-1-oxoethyl]-3-hydroxyphenyl] ester S-[4-[2-(1,3-benzodioxol-5-yl)acetyl]-3-hydroxyphenyl] N,N-dimethylcarbamothioate S-[4-[2-(1,3-benzodioxol-5-yl)acetyl]-3-hydroxy-phenyl] N,N-dimethylcarbamothioate S-[4-[2-(1,3-benzodioxol-5-yl)ethanoyl]-3-oxidanyl-phenyl] N,N-dimethylcarbamothioate
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Formula C18H17NO5S
InChI InChI=1S/C18H17NO5S/c1-19(2)18(22)25-12-4-5-13(15(21)9-12)14(20)7-11-3-6-16-17(8-11)24-10-23-16/h3-6,8-9,21H,7,10H2,1-2H3
InChIKey MARPVNGCODMIHY-UHFFFAOYSA-N
Molecular Weight 359.396 g/mol
SMILES Oc1cc(SC(N(C)C)=O)ccc1C(Cc1cc2OCOc2cc1)=O
SPLASH splash10-00di-9120000000-11a8ea4eca28ccbe81c2
Source of Spectrum SK-22-1746-12
Wiley ID 852076