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2-[3-(N,N-(Dimethylcarbamoylthio)-4-methoxyphenyl]-4H-3,1-benzoxathiine
SpectraBase Compound ID FropvSwXW9z
InChI InChI=1S/C18H19NO3S2/c1-19(2)18(20)24-16-10-12(8-9-14(16)21-3)17-22-11-13-6-4-5-7-15(13)23-17/h4-10,17H,11H2,1-3H3
InChIKey SEGUOZKOMGRILO-UHFFFAOYSA-N
Mol Weight 361.47 g/mol
Molecular Formula C18H19NO3S2
Exact Mass 361.080636 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KZSS4kLDcqD
Name 2-[3-(N,N-(Dimethylcarbamoylthio)-4-methoxyphenyl]-4H-3,1-benzoxathiine
Alternate Name(s) S-[5-(4H-3,1-benzoxathiin-2-yl)-2-methoxyphenyl]dimethylthiocarbamate
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Formula C18H19NO3S2
InChI InChI=1S/C18H19NO3S2/c1-19(2)18(20)24-16-10-12(8-9-14(16)21-3)17-22-11-13-6-4-5-7-15(13)23-17/h4-10,17H,11H2,1-3H3
InChIKey SEGUOZKOMGRILO-UHFFFAOYSA-N
Molecular Weight 361.474 g/mol
SMILES C(Sc1cc(C2Sc3ccccc3CO2)ccc1OC)(N(C)C)=O
SPLASH splash10-00di-0911000000-38924c4ec0783ced9585
Source of Spectrum KC-1993-1365-22
Wiley ID 778054