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[1,2,4]Triazolo[1,5-a]pyrimidine-6-carboxylic acid, 4,7-dihydro-7-imino-2-(methylthio)-, ethyl ester
SpectraBase Compound ID 4EkvTeEMoCK
InChI InChI=1S/C9H11N5O2S/c1-3-16-7(15)5-4-11-8-12-9(17-2)13-14(8)6(5)10/h4,10H,3H2,1-2H3,(H,11,12,13)
InChIKey UGKZQHZFHCGRRC-UHFFFAOYSA-N
Mol Weight 253.28 g/mol
Molecular Formula C9H11N5O2S
Exact Mass 253.063346 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1dzUxOyMQBS
Name [1,2,4]Triazolo[1,5-a]pyrimidine-6-carboxylic acid, 4,7-dihydro-7-imino-2-(methylthio)-, ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11N5O2S
InChI InChI=1S/C9H11N5O2S/c1-3-16-7(15)5-4-11-8-12-9(17-2)13-14(8)6(5)10/h4,10H,3H2,1-2H3,(H,11,12,13)
InChIKey UGKZQHZFHCGRRC-UHFFFAOYSA-N
Molecular Weight 253.280 g/mol
SMILES N=C1[n]2nc(nc2NC=C1C(OCC)=O)SC
SPLASH splash10-0udi-9320000000-ceaa058ff7017c80ba56
Source of Spectrum IY-2-4946-6
Wiley ID 1657449