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

*Links on SpectraBase are not permalinks.
HEYJGDLJGAFHKU-UHFFFAOYSA-N
SpectraBase Compound ID CuPuNQ3WRtR
InChI InChI=1S/C9H8N4O3/c1-2-5(14)4-3-10-7-6(11-4)8(15)13-9(16)12-7/h3H,2H2,1H3,(H2,10,12,13,15,16)
InChIKey HEYJGDLJGAFHKU-UHFFFAOYSA-N
Mol Weight 220.19 g/mol
Molecular Formula C9H8N4O3
Exact Mass 220.05964 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 JBjUfONoczu
Name 6-(1-oxopropyl)-1H-pteridine-2,4-dione
Alternate Name(s) 6-Propanoyl-1H-pteridine-2,4-dione 6-Propionyl-1H-pteridine-2,4-quinone 6-Propionylpteridine-2,4(1H,3H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N4O3
InChI InChI=1S/C9H8N4O3/c1-2-5(14)4-3-10-7-6(11-4)8(15)13-9(16)12-7/h3H,2H2,1H3,(H2,10,12,13,15,16)
InChIKey HEYJGDLJGAFHKU-UHFFFAOYSA-N
Molecular Weight 220.188 g/mol
SMILES N1C(Nc2c(C1=O)nc(cn2)C(=O)CC)=O
SPLASH splash10-0006-0900000000-201b31a1747a892be785
Source of Spectrum KC-0-95-4
Wiley ID 829816