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2,3-Dihydro-6,7-dihydroxy-8-methyl-2-thioxo-1H-pyrimido[4,5-b]indol-4(9H)-one
SpectraBase Compound ID H3Wk1eviage
InChI InChI=1S/C11H9N3O3S/c1-3-7-4(2-5(15)8(3)16)6-9(12-7)13-11(18)14-10(6)17/h2,15-16H,1H3,(H3,12,13,14,17,18)
InChIKey YEYCJLOMFIXLTG-UHFFFAOYSA-N
Mol Weight 263.27 g/mol
Molecular Formula C11H9N3O3S
Exact Mass 263.036462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5kSNqn9yNj
Name 2,3-Dihydro-6,7-dihydroxy-8-methyl-2-thioxo-1H-pyrimido[4,5-b]indol-4(9H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9N3O3S
InChI InChI=1S/C11H9N3O3S/c1-3-7-4(2-5(15)8(3)16)6-9(12-7)13-11(18)14-10(6)17/h2,15-16H,1H3,(H3,12,13,14,17,18)
InChIKey YEYCJLOMFIXLTG-UHFFFAOYSA-N
Molecular Weight 263.271 g/mol
SMILES N1C(c2c3c(c(c(c(c3)O)O)C)[nH]c2NC1=S)=O
SPLASH splash10-03xy-9550000000-3c5c1d2eec664658394c
Source of Spectrum Y-47-44-8e
Synonyms 6,7-Dihydroxy-8-methyl-2-sulfanylidene-1,9-dihydropyrimido[4,5-b]indol-4-one 6,7-Dihydroxy-8-methyl-2-thioxo-1,9-dihydropyrimido[4,5-b]indol-4-one 8-Methyl-6,7-bis(oxidanyl)-2-sulfanylidene-1,9-dihydropyrimido[4,5-b]indol-4-one
Wiley ID 1711125