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Ethyl 5-(methylthio)-2-(m-nitrophenyl)[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
SpectraBase Compound ID 30TtISOJ84z
InChI InChI=1S/C15H13N5O4S/c1-3-24-14(21)11-8-16-15(25-2)19-13(11)17-12(18-19)9-5-4-6-10(7-9)20(22)23/h4-8H,3H2,1-2H3
InChIKey XLOAVUGZLQGOFG-UHFFFAOYSA-N
Mol Weight 359.36 g/mol
Molecular Formula C15H13N5O4S
Exact Mass 359.068825 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Ypk3jNy8ig
Name Ethyl 5-(methylthio)-2-(m-nitrophenyl)[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Alternate Name(s) Ethyl 5-(methylsulfanyl)-2-(3-nitrophenyl)[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
CAS Registry Number 78515-02-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13N5O4S
InChI InChI=1S/C15H13N5O4S/c1-3-24-14(21)11-8-16-15(25-2)19-13(11)17-12(18-19)9-5-4-6-10(7-9)20(22)23/h4-8H,3H2,1-2H3
InChIKey XLOAVUGZLQGOFG-UHFFFAOYSA-N
Molecular Weight 359.360 g/mol
SMILES c12[n](nc(n2)-c2cc(N(=O)=O)ccc2)C(=NC=C1C(=O)OCC)SC
SPLASH splash10-000i-0096000000-d4e1a21b5aeaafc6761c
Source of Spectrum J-46-3959-0
Wiley ID 1347641