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

*Links on SpectraBase are not permalinks.
Ethyl 3-(3'-nitrophenyl)-5-oxo-4,5-dihydro-1,2,4-triazine-6-carboxylate
SpectraBase Compound ID CjfbKqRXBqs
InChI InChI=1S/C12H10N4O5/c1-2-21-12(18)9-11(17)13-10(15-14-9)7-4-3-5-8(6-7)16(19)20/h3-6H,2H2,1H3,(H,13,15,17)
InChIKey APOJTKWNCWCEGR-UHFFFAOYSA-N
Mol Weight 290.23 g/mol
Molecular Formula C12H10N4O5
Exact Mass 290.065119 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 FwVIbAfFWjI
Name Ethyl 3-(3'-nitrophenyl)-5-oxo-4,5-dihydro-1,2,4-triazine-6-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N4O5
InChI InChI=1S/C12H10N4O5/c1-2-21-12(18)9-11(17)13-10(15-14-9)7-4-3-5-8(6-7)16(19)20/h3-6H,2H2,1H3,(H,13,15,17)
InChIKey APOJTKWNCWCEGR-UHFFFAOYSA-N
Molecular Weight 290.235 g/mol
SMILES N1C(=NN=C(C1=O)C(=O)OCC)c1cc(N(=O)=O)ccc1
SPLASH splash10-000i-9020000000-0700664c0476178430ae
Source of Spectrum G-68-970-8
Synonyms ethyl 3-(3-nitrophenyl)-5-oxo-4,5-dihydro-1,2,4-triazine-6-carboxylate
Wiley ID 1520372