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

*Links on SpectraBase are not permalinks.
3-[(6-Chloropyridin-3-yl)methyl]-6-isobutyl-6,7-dihydro-3H-1,2,3-triazolo-[4,5-d]pyrimidin-7-imine
SpectraBase Compound ID FvJ3i0h44ud
InChI InChI=1S/C14H16ClN7/c1-9(2)6-21-8-18-14-12(13(21)16)19-20-22(14)7-10-3-4-11(15)17-5-10/h3-5,8-9,16H,6-7H2,1-2H3
InChIKey VJZKSYONJXUIJR-UHFFFAOYSA-N
Mol Weight 317.78 g/mol
Molecular Formula C14H16ClN7
Exact Mass 317.115571 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 2LJ3ChALMu
Name 3-[(6-Chloropyridin-3-yl)methyl]-6-isobutyl-6,7-dihydro-3H-1,2,3-triazolo-[4,5-d]pyrimidin-7-imine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16ClN7
InChI InChI=1S/C14H16ClN7/c1-9(2)6-21-8-18-14-12(13(21)16)19-20-22(14)7-10-3-4-11(15)17-5-10/h3-5,8-9,16H,6-7H2,1-2H3
InChIKey VJZKSYONJXUIJR-UHFFFAOYSA-N
Molecular Weight 317.784 g/mol
SMILES N=C1c2c([n](Cc3cnc(cc3)Cl)nn2)N=CN1CC(C)C
SPLASH splash10-00pi-1984000000-6c1b4ac53b19538b7687
Source of Spectrum Y-45-1495-4a
Synonyms 3-[(6-chloro-3-pyridinyl)methyl]-6-(2-methylpropyl)-7-triazolo[4,5-d]pyrimidinimine 3-[(6-chloropyridin-3-yl)methyl]-6-(2-methylpropyl)triazolo[4,5-d]pyrimidin-7-imine 3-[(6-chloro-3-pyridyl)methyl]-6-isobutyl-triazolo[4,5-d]pyrimidin-7-imine 3-[(6-chloranylpyridin-3-yl)methyl]-6-(2-methylpropyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-imine
Wiley ID 1666664