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

*Links on SpectraBase are not permalinks.
2-(1,3-benzodioxol-5-yl)-3-methoxy-6-(4-pyridylmethylsulfanyl)imidazo[1,2-b]pyridazine
SpectraBase Compound ID LRsYmNPBRHU
InChI InChI=1S/C20H16N4O3S/c1-25-20-19(14-2-3-15-16(10-14)27-12-26-15)22-17-4-5-18(23-24(17)20)28-11-13-6-8-21-9-7-13/h2-10H,11-12H2,1H3
InChIKey MHNSMNINLHFZDH-UHFFFAOYSA-N
Mol Weight 392.43 g/mol
Molecular Formula C20H16N4O3S
Exact Mass 392.094312 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 KQ3r1zM4WH6
Name 2-(1,3-benzodioxol-5-yl)-3-methoxy-6-(4-pyridylmethylsulfanyl)imidazo[1,2-b]pyridazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16N4O3S
InChI InChI=1S/C20H16N4O3S/c1-25-20-19(14-2-3-15-16(10-14)27-12-26-15)22-17-4-5-18(23-24(17)20)28-11-13-6-8-21-9-7-13/h2-10H,11-12H2,1H3
InChIKey MHNSMNINLHFZDH-UHFFFAOYSA-N
Molecular Weight 392.433 g/mol
SMILES c1([n]2c(nc1-c1cc3OCOc3cc1)C=CC(=N2)SCc1ccncc1)OC
SPLASH splash10-0007-0009000000-dcbd59a4b83ee1437eb5
Source of Spectrum JA-50-91-0
Synonyms 2-(1,3-benzodioxol-5-yl)-3-methoxy-6-(4-pyridylmethylthio)imidazo[1,2-b]pyridazine 2-(1,3-benzodioxol-5-yl)-3-methoxy-6-(pyridin-4-ylmethylsulfanyl)imidazo[1,2-b]pyridazine 2-(1,3-benzodioxol-5-yl)-3-methoxy-6-(pyridin-4-ylmethylthio)imidazo[1,2-b]pyridazine
Wiley ID 1365699