3-(Benzenesulfonyl)-2-dodecyl-1H-pyrrolo[2,3-b]pyridine

SpectraBase Compound ID	LtsBTViBdui
InChI	InChI=1S/C25H34N2O2S/c1-2-3-4-5-6-7-8-9-10-14-19-23-24(22-18-15-20-26-25(22)27-23)30(28,29)21-16-12-11-13-17-21/h11-13,15-18,20H,2-10,14,19H2,1H3,(H,26,27)
InChIKey	BXIZOLIPKCJFDZ-UHFFFAOYSA-N Google Search
Mol Weight	426.6 g/mol
Molecular Formula	C25H34N2O2S
Exact Mass	426.2341 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	KDzhbd1qSqb
Name	3-(Benzenesulfonyl)-2-dodecyl-1H-pyrrolo[2,3-b]pyridine
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C25H34N2O2S
InChI	InChI=1S/C25H34N2O2S/c1-2-3-4-5-6-7-8-9-10-14-19-23-24(22-18-15-20-26-25(22)27-23)30(28,29)21-16-12-11-13-17-21/h11-13,15-18,20H,2-10,14,19H2,1H3,(H,26,27)
InChIKey	BXIZOLIPKCJFDZ-UHFFFAOYSA-N
Literature Reference DOI	10.1021/jo502150v
Molecular Weight	426.619 g/mol
SMILES	[nH]1c2c(c(c1CCCCCCCCCCCC)S(=O)(c1ccccc1)=O)cccn2
SPLASH	splash10-001r-9042100000-a3473e9e84681bc79662
Source of Spectrum	J-79-11273-16c
Synonyms	2-Dodecyl-3-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine
Wiley ID	1755712