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4-Pteridinecarboxylic acid, 1,2,3,4-tetrahydro-4-hydroxy-2-thioxo-, ethyl ester
SpectraBase Compound ID 1uGAgR2WtCc
InChI InChI=1S/C9H10N4O3S/c1-2-16-7(14)9(15)5-6(11-4-3-10-5)12-8(17)13-9/h3-4,15H,2H2,1H3,(H2,11,12,13,17)
InChIKey HNEQTKJEHIYTGN-UHFFFAOYSA-N
Mol Weight 254.26 g/mol
Molecular Formula C9H10N4O3S
Exact Mass 254.047361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6XIKU4qyD4M
Name 4-Pteridinecarboxylic acid, 1,2,3,4-tetrahydro-4-hydroxy-2-thioxo-, ethyl ester
Alternate Name(s) Ethyl 4-hydroxy-2-thioxo-1,2,3,4-tetrahydro-4-pteridinecarboxylate 4-Hydroxy-2-sulfanylidene-1,3-dihydropteridine-4-carboxylic acid ethyl ester 4-Hydroxy-2-thioxo-1,3-dihydropteridine-4-carboxylic acid ethyl ester Ethyl 4-hydroxy-2-sulfanylidene-1,3-dihydropteridine-4-carboxylate Ethyl 4-hydroxy-2-thioxo-1,3-dihydropteridine-4-carboxylate Ethyl 4-oxidanyl-2-sulfanylidene-1,3-dihydropteridine-4-carboxylate
CAS Registry Number 18204-27-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10N4O3S
InChI InChI=1S/C9H10N4O3S/c1-2-16-7(14)9(15)5-6(11-4-3-10-5)12-8(17)13-9/h3-4,15H,2H2,1H3,(H2,11,12,13,17)
InChIKey HNEQTKJEHIYTGN-UHFFFAOYSA-N
Molecular Weight 254.264 g/mol
SMILES N1C(=NC(c2c1nccn2)(C(=O)OCC)O)S
SPLASH splash10-0gx9-3910000000-53cb8a95c32fdf028906
Source of Spectrum O-7-749-7
Wiley ID 1257163