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

*Links on SpectraBase are not permalinks.
3-(4-Chlorophenyl)-5-di(n-propyl)amino-6-phenyl-3,6-dihydro-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one
SpectraBase Compound ID tGTzup3m5M
InChI InChI=1S/C22H23ClN6O/c1-3-14-27(15-4-2)22-24-20-19(21(30)28(22)17-8-6-5-7-9-17)25-26-29(20)18-12-10-16(23)11-13-18/h5-13H,3-4,14-15H2,1-2H3
InChIKey RYUZBDHFVWCMQT-UHFFFAOYSA-N
Mol Weight 422.92 g/mol
Molecular Formula C22H23ClN6O
Exact Mass 422.162187 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 6PnzIslewkT
Name 3-(4-Chlorophenyl)-5-di(n-propyl)amino-6-phenyl-3,6-dihydro-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one
Alternate Name(s) 3-(4-Chlorophenyl)-5-(dipropylamino)-6-phenyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7(6H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23ClN6O
InChI InChI=1S/C22H23ClN6O/c1-3-14-27(15-4-2)22-24-20-19(21(30)28(22)17-8-6-5-7-9-17)25-26-29(20)18-12-10-16(23)11-13-18/h5-13H,3-4,14-15H2,1-2H3
InChIKey RYUZBDHFVWCMQT-UHFFFAOYSA-N
Molecular Weight 422.920 g/mol
SMILES C1(=Nc2c(C(N1c1ccccc1)=O)nn[n]2-c1ccc(cc1)Cl)N(CCC)CCC
SPLASH splash10-004r-8901100000-7cc52d30fc94281e1c39
Source of Spectrum CJC-29-992-4a
Wiley ID 1772567