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

*Links on SpectraBase are not permalinks.
4-Methyl-1-(methylsulfanyl)-5H-pyridazino[4,5-b]indole
SpectraBase Compound ID 4sHGuFGzJS3
InChI InChI=1S/C12H11N3S/c1-7-11-10(12(16-2)15-14-7)8-5-3-4-6-9(8)13-11/h3-6,13H,1-2H3
InChIKey PENNSSGAXVFJAM-UHFFFAOYSA-N
Mol Weight 229.3 g/mol
Molecular Formula C12H11N3S
Exact Mass 229.067369 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 CRYhvU0AxJ2
Name 4-Methyl-1-(methylsulfanyl)-5H-pyridazino[4,5-b]indole
Appearance Buff crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 229.067368540 u
Formula C12H11N3S
InChI InChI=1S/C12H11N3S/c1-7-11-10(12(16-2)15-14-7)8-5-3-4-6-9(8)13-11/h3-6,13H,1-2H3
InChIKey PENNSSGAXVFJAM-UHFFFAOYSA-N
Instrument Name Shimadzu QP 5050A DI 50
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.e19
Molecular Weight 229.301 g/mol
Quality 451
Reported Formula C12H11N3S
SMILES N1C2=C(C=3C1=C(N=NC3SC)C)C=CC=C2
SPLASH splash10-00ou-2950000000-71120c780b8a3151a190
Source of Spectrum ARK-2003-207-16 (DOI: 10.3998/ark.5550190.0004.e19)
Wiley ID 1899823