For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-(4-nitrophenyl)-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid ethyl ester
SpectraBase Compound ID 5ldbzS8JXfg
InChI InChI=1S/C14H10N4O5S/c1-2-23-13(20)10-7-11(19)15-14-17(10)16-12(24-14)8-3-5-9(6-4-8)18(21)22/h3-7H,2H2,1H3
InChIKey QGMQXUIOUAKQOO-UHFFFAOYSA-N
Mol Weight 346.32 g/mol
Molecular Formula C14H10N4O5S
Exact Mass 346.037191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6fx9WxdhgkA
Name 2-(4-nitrophenyl)-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid ethyl ester
CAS Registry Number 82077-88-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10N4O5S
InChI InChI=1S/C14H10N4O5S/c1-2-23-13(20)10-7-11(19)15-14-17(10)16-12(24-14)8-3-5-9(6-4-8)18(21)22/h3-7H,2H2,1H3
InChIKey QGMQXUIOUAKQOO-UHFFFAOYSA-N
Molecular Weight 346.317 g/mol
SMILES CCOC(C1=CC(N=C2N1N=C(c1ccc(cc1)N(=O)=O)S2)=O)=O
SPLASH splash10-0002-9226000000-25328157ae32ab2882c1
Source of Spectrum W5-1989-37958-27578
Synonyms 7-keto-2-(4-nitrophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid ethyl ester Ethyl 2-(4-nitrophenyl)-7-oxidanylidene-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylate Ethyl 2-(4-nitrophenyl)-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylate
Wiley ID 1338910