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

*Links on SpectraBase are not permalinks.
5-(2-chlorobenzylidene)-10-(2-chlorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d][1,2,4]triazolo[1,5-a]pyrimidine
SpectraBase Compound ID EfoUtkCFogR
InChI InChI=1S/C23H18Cl2N4/c24-19-11-5-2-7-15(19)13-16-8-1-3-10-18-21(16)28-23-26-14-27-29(23)22(18)17-9-4-6-12-20(17)25/h2,4-7,9,11-14H,1,3,8,10H2
InChIKey FBJOWGMZITULSN-UHFFFAOYSA-N
Mol Weight 421.33 g/mol
Molecular Formula C23H18Cl2N4
Exact Mass 420.090852 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 JbbPZqvE42x
Name 5-(2-chlorobenzylidene)-10-(2-chlorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d][1,2,4]triazolo[1,5-a]pyrimidine
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18Cl2N4
InChI InChI=1S/C23H18Cl2N4/c24-19-11-5-2-7-15(19)13-16-8-1-3-10-18-21(16)28-23-26-14-27-29(23)22(18)17-9-4-6-12-20(17)25/h2,4-7,9,11-14H,1,3,8,10H2
InChIKey FBJOWGMZITULSN-UHFFFAOYSA-N
Instrument Name Shimadzu QP 1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3792
Molecular Weight 421.331 g/mol
SMILES c1(Cl)c(C=C2C=3C(CCCC2)=C([n]2c(N3)ncn2)c2c(cccc2)Cl)cccc1
SPLASH splash10-008c-0009000000-1bfcd33f772567a81016
Source of Spectrum Y-57-615-7
Wiley ID 1860008