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

*Links on SpectraBase are not permalinks.
N-(3-Phenylprop-2-yn-1-yl)-S-(2-bromophenyl)-S-methyl sulfoximine
SpectraBase Compound ID Gr8CauKTSSB
InChI InChI=1S/C16H14BrNOS/c1-20(19,16-12-6-5-11-15(16)17)18-13-7-10-14-8-3-2-4-9-14/h2-6,8-9,11-12H,13H2,1H3
InChIKey YZSUFFBCFZPOOP-UHFFFAOYSA-N
Mol Weight 348.26 g/mol
Molecular Formula C16H14BrNOS
Exact Mass 346.997948 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 wvtkyL2CPE
Name N-(3-Phenylprop-2-yn-1-yl)-S-(2-bromophenyl)-S-methyl sulfoximine
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.997948248 u
Formula C16H14BrNOS
InChI InChI=1S/C16H14BrNOS/c1-20(19,16-12-6-5-11-15(16)17)18-13-7-10-14-8-3-2-4-9-14/h2-6,8-9,11-12H,13H2,1H3
InChIKey YZSUFFBCFZPOOP-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201700953
Molecular Weight 348.258 g/mol
Quality 98
Reported Formula C16H14BrNOS
SMILES C1(S(=NCC#CC2=CC=CC=C2)(C)=O)=C(C=CC=C1)Br
SPLASH splash10-0v00-2900000000-8d5cde3ed2c38d6d37ff
Source of Spectrum QE-23-SM3-4e (DOI: 10.1002/chem.201700953)
Wiley ID 1905750