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3-(dimethylsulfuranylideneamino)-1,4-diketo-naphthalene-2-carboxylic acid methyl ester
SpectraBase Compound ID I716oo5FYOb
InChI InChI=1S/C14H13NO4S/c1-19-14(18)10-11(15-20(2)3)13(17)9-7-5-4-6-8(9)12(10)16/h4-7H,1-3H3
InChIKey WLQLKINWBMQGHA-UHFFFAOYSA-N
Mol Weight 291.32 g/mol
Molecular Formula C14H13NO4S
Exact Mass 291.056529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6pKF5paPbmg
Name 3-(dimethylsulfuranylideneamino)-1,4-diketo-naphthalene-2-carboxylic acid methyl ester
CAS Registry Number 101130-75-0
Comments Less than 3 mono-isotopic peaks
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Formula C14H13NO4S
InChI InChI=1S/C14H13NO4S/c1-19-14(18)10-11(15-20(2)3)13(17)9-7-5-4-6-8(9)12(10)16/h4-7H,1-3H3
InChIKey WLQLKINWBMQGHA-UHFFFAOYSA-N
Molecular Weight 291.321 g/mol
SMILES C1(=C(C(=O)c2c(C1=O)cccc2)C(=O)OC)N=S(C)C
SPLASH splash10-03di-9010000000-1d32d1de6f1cc779421e
Source of Spectrum Y-22-704-11
Synonyms 3-[(dimethyl-$l^{4}-sulfanylidene)amino]-1,4-dioxo-2-naphthalenecarboxylic acid methyl ester methyl 3-[(dimethyl-$l^{4}-sulfanylidene)amino]-1,4-dioxonaphthalene-2-carboxylate methyl 3-[(dimethyl-$l^{4}-sulfanylidene)amino]-1,4-dioxo-naphthalene-2-carboxylate
Wiley ID 1294415