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

*Links on SpectraBase are not permalinks.
8-(1-imidazolylmethyl)-5-nitro-1-benzopyran-4-one
SpectraBase Compound ID DX53XzeWLix
InChI InChI=1S/C13H9N3O4/c17-11-3-6-20-13-9(7-15-5-4-14-8-15)1-2-10(12(11)13)16(18)19/h1-6,8H,7H2
InChIKey YKATXTHPSQAGQZ-UHFFFAOYSA-N
Mol Weight 271.23 g/mol
Molecular Formula C13H9N3O4
Exact Mass 271.059306 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 99g7xHFXNTl
Name 8-(1-imidazolylmethyl)-5-nitro-1-benzopyran-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9N3O4
InChI InChI=1S/C13H9N3O4/c17-11-3-6-20-13-9(7-15-5-4-14-8-15)1-2-10(12(11)13)16(18)19/h1-6,8H,7H2
InChIKey YKATXTHPSQAGQZ-UHFFFAOYSA-N
Molecular Weight 271.232 g/mol
SMILES c12c(N(=O)=O)ccc(c2OC=CC1=O)C[n]1cncc1
SPLASH splash10-014i-9100000000-81af4c4865cb8c287a4a
Source of Spectrum F2-44-679-22
Synonyms 8-(imidazol-1-ylmethyl)-5-nitro-chromen-4-one 8-(imidazol-1-ylmethyl)-5-nitro-chromone
Wiley ID 1639078