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

*Links on SpectraBase are not permalinks.
2-[3-(2,4-Dioxo-5-propyl-3,4-dihydro-1(2H)-pyrimidinyl)propyl]-1,2,4-triazine-3,5(2H,4H)-dione
SpectraBase Compound ID IneNIbbumt1
InChI InChI=1S/C13H17N5O4/c1-2-4-9-8-17(12(21)16-11(9)20)5-3-6-18-13(22)15-10(19)7-14-18/h7-8H,2-6H2,1H3,(H,15,19,22)(H,16,20,21)
InChIKey VYOWHPGWCHAOOY-UHFFFAOYSA-N
Mol Weight 307.31 g/mol
Molecular Formula C13H17N5O4
Exact Mass 307.128054 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 5FtL4MybCGH
Name 2-[3-(2,4-Dioxo-5-propyl-3,4-dihydro-1(2H)-pyrimidinyl)propyl]-1,2,4-triazine-3,5(2H,4H)-dione
CAS Registry Number 79936-28-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N5O4
InChI InChI=1S/C13H17N5O4/c1-2-4-9-8-17(12(21)16-11(9)20)5-3-6-18-13(22)15-10(19)7-14-18/h7-8H,2-6H2,1H3,(H,15,19,22)(H,16,20,21)
InChIKey VYOWHPGWCHAOOY-UHFFFAOYSA-N
Molecular Weight 307.310 g/mol
SMILES N1C(N(CCCN2C=C(C(NC2=O)=O)CCC)N=CC1=O)=O
SPLASH splash10-0ufr-9610000000-263dbd0da5e8c7d64468
Source of Spectrum O-19-145-4
Synonyms 1-(6-Aza-uracil-1-yl)-3-(5-propyl-uracil-1-yl)propane 2-[3-(2,4-diketo-5-propyl-pyrimidin-1-yl)propyl]-1,2,4-triazine-3,5-quinone 2-[3-(2,4-dioxo-5-propyl-1-pyrimidinyl)propyl]-1,2,4-triazine-3,5-dione 2-[3-(2,4-dioxo-5-propyl-pyrimidin-1-yl)propyl]-1,2,4-triazine-3,5-dione 2-[3-[2,4-bis(oxidanylidene)-5-propyl-pyrimidin-1-yl]propyl]-1,2,4-triazine-3,5-dione
Wiley ID 1308813