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

*Links on SpectraBase are not permalinks.
Benzo[3,4]cyclobuta[1,2-d]pyrimidine, 4-chloro-
SpectraBase Compound ID 1PNonyyZYed
InChI InChI=1S/C10H5ClN2/c11-10-8-6-3-1-2-4-7(6)9(8)12-5-13-10/h1-5H
InChIKey XUGRUCXIAJAKBH-UHFFFAOYSA-N
Mol Weight 188.62 g/mol
Molecular Formula C10H5ClN2
Exact Mass 188.014126 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 4rBizCloMMj
Name Benzo[3,4]cyclobuta[1,2-d]pyrimidine, 4-chloro-
CAS Registry Number 87954-04-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H5ClN2
InChI InChI=1S/C10H5ClN2/c11-10-8-6-3-1-2-4-7(6)9(8)12-5-13-10/h1-5H
InChIKey XUGRUCXIAJAKBH-UHFFFAOYSA-N
Molecular Weight 188.617 g/mol
SMILES c-12c(ncnc2Cl)-c2c1cccc2
SPLASH splash10-03dr-0900000000-15a8106955957851c0ff
Source of Spectrum J-49-294-0
Synonyms 4-Chloro-1,3-diazabiphenylene 4-chlorobenzo[3,4]cyclobuta[1,2-d]pyrimidine
Wiley ID 1184497