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

*Links on SpectraBase are not permalinks.
5-methyl-2-(p-tolylsulfonyl)-1,3-dihydrobenzofuro[2,3-c]azepine
SpectraBase Compound ID 8XqOqDKVadI
InChI InChI=1S/C20H19NO3S/c1-14-7-9-16(10-8-14)25(22,23)21-12-11-15(2)20-17-5-3-4-6-18(17)24-19(20)13-21/h3-11H,12-13H2,1-2H3
InChIKey JALRJXWMQMUBOM-UHFFFAOYSA-N
Mol Weight 353.44 g/mol
Molecular Formula C20H19NO3S
Exact Mass 353.108565 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 Kgti3Wv7cxo
Name 5-methyl-2-(p-tolylsulfonyl)-1,3-dihydrobenzofuro[2,3-c]azepine
Appearance White solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.108564647 u
Formula C20H19NO3S
InChI InChI=1S/C20H19NO3S/c1-14-7-9-16(10-8-14)25(22,23)21-12-11-15(2)20-17-5-3-4-6-18(17)24-19(20)13-21/h3-11H,12-13H2,1-2H3
InChIKey JALRJXWMQMUBOM-UHFFFAOYSA-N
Instrument Name HP-5989
Ionization Type EI
Literature Reference DOI 10.1002/chem.201602545
Molecular Weight 353.436 g/mol
Reported Formula C20H19NO3S
SMILES C12=CC=CC=C2OC2=C1C(=CCN(C2)S(C1=CC=C(C=C1)C)(=O)=O)C
SPLASH splash10-0002-0900000000-48b45495c7756aeca036
Source of Spectrum QE-22-SM103-14 (DOI: 10.1002/chem.201602545)
Wiley ID 1905127