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

*Links on SpectraBase are not permalinks.

4-Benzylthio-5-azacinnoline

View entire compound with spectra: 1 MS (GC)

4-Benzylthio-5-azacinnoline
SpectraBase Compound ID 9qW8G0BcwC5
InChI InChI=1S/C14H11N3S/c1-2-5-11(6-3-1)10-18-13-9-16-17-12-7-4-8-15-14(12)13/h1-9H,10H2
InChIKey XJZJXQBKBXADBH-UHFFFAOYSA-N
Mol Weight 253.32 g/mol
Molecular Formula C14H11N3S
Exact Mass 253.067369 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 Ji5gNbG4S5i
Name 4-Benzylthio-5-azacinnoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11N3S
InChI InChI=1S/C14H11N3S/c1-2-5-11(6-3-1)10-18-13-9-16-17-12-7-4-8-15-14(12)13/h1-9H,10H2
InChIKey XJZJXQBKBXADBH-UHFFFAOYSA-N
Molecular Weight 253.323 g/mol
SMILES c12c(SCc3ccccc3)cnnc1cccn2
SPLASH splash10-0006-9020000000-c2638d4758f6e51ac5f1
Source of Spectrum HC-14-1034-0
Synonyms 4-(benzylsulfanyl)pyrido[3,2-c]pyridazine benzyl pyrido[3,2-c]pyridazin-4-yl sulfide 4-(Phenylmethylthio)pyrido[3,2-c]pyridazine 4-Benzylsulfanylpyrido[3,2-c]pyridazine 4-(Phenylmethylsulfanyl)pyrido[3,2-c]pyridazine
Wiley ID 1256776