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1H-isoindole-4-carboxylic acid, 2,3-dihydro-3-oxo-2-(2-thienylmethyl)-
SpectraBase Compound ID 6LQcXFzOTSg
InChI InChI=1S/C14H11NO3S/c16-13-12-9(3-1-5-11(12)14(17)18)7-15(13)8-10-4-2-6-19-10/h1-6H,7-8H2,(H,17,18)
InChIKey VWVPWLGLDOABBA-UHFFFAOYSA-N
Mol Weight 273.31 g/mol
Molecular Formula C14H11NO3S
Exact Mass 273.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H05YSZaBfRp
Name 1H-Isoindole-4-carboxylic acid, 2,3-dihydro-3-oxo-2-(2-thienylmethyl)-
Alternate Name(s) 3-keto-2-(2-thenyl)isoindoline-4-carboxylic acid 3-Oxidanylidene-2-(thiophen-2-ylmethyl)-1H-isoindole-4-carboxylic acid 3-Oxo-2-(2-thienylmethyl)isoindoline-4-carboxylic acid 3-Oxo-2-(thiophen-2-ylmethyl)-1H-isoindole-4-carboxylic acid
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Formula C14H11NO3S
InChI InChI=1S/C14H11NO3S/c16-13-12-9(3-1-5-11(12)14(17)18)7-15(13)8-10-4-2-6-19-10/h1-6H,7-8H2,(H,17,18)
InChIKey VWVPWLGLDOABBA-UHFFFAOYSA-N
Molecular Weight 273.306 g/mol
SMILES OC(c1cccc2c1C(N(Cc1sccc1)C2)=O)=O
SPLASH splash10-002b-9230000000-5b67d9e3bac035503e0a
Wiley ID 1449012