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5-(tert-butoxycarbonylamino)thiophene-2-carboxylic acid benzyl ester
SpectraBase Compound ID 5sTXgyZsb8u
InChI InChI=1S/C17H19NO4S/c1-17(2,3)22-16(20)18-14-10-9-13(23-14)15(19)21-11-12-7-5-4-6-8-12/h4-10H,11H2,1-3H3,(H,18,20)
InChIKey WCERSCDESMAMAK-UHFFFAOYSA-N
Mol Weight 333.4 g/mol
Molecular Formula C17H19NO4S
Exact Mass 333.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4lG2J7A7guk
Name (phenylmethyl) 5-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylate
Alternate Name(s) 5-(tert-butoxycarbonylamino)thiophene-2-carboxylic acid benzyl ester 5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-thiophenecarboxylic acid (phenylmethyl) ester benzyl 5-(tert-butoxycarbonylamino)thiophene-2-carboxylate benzyl 5-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylate
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Formula C17H19NO4S
InChI InChI=1S/C17H19NO4S/c1-17(2,3)22-16(20)18-14-10-9-13(23-14)15(19)21-11-12-7-5-4-6-8-12/h4-10H,11H2,1-3H3,(H,18,20)
InChIKey WCERSCDESMAMAK-UHFFFAOYSA-N
Molecular Weight 333.402 g/mol
SMILES N(c1sc(C(OCc2ccccc2)=O)cc1)C(OC(C)(C)C)=O
SPLASH splash10-0a4l-9110000000-0221f698adc4f5b5f2a6
Source of Spectrum C5-2004-1638-7
Wiley ID 1617002