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

*Links on SpectraBase are not permalinks.
1-Benzyl-4-[3-(methylsulfonyl)phenyl]piperazine
SpectraBase Compound ID BQcFEIn0AUu
InChI InChI=1S/C18H22N2O2S/c1-23(21,22)18-9-5-8-17(14-18)20-12-10-19(11-13-20)15-16-6-3-2-4-7-16/h2-9,14H,10-13,15H2,1H3
InChIKey DABGEKAEKHHGFN-UHFFFAOYSA-N
Mol Weight 330.45 g/mol
Molecular Formula C18H22N2O2S
Exact Mass 330.140199 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 1QT82m1Me5a
Name 1-Benzyl-4-[3-(methylsulfonyl)phenyl]piperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22N2O2S
InChI InChI=1S/C18H22N2O2S/c1-23(21,22)18-9-5-8-17(14-18)20-12-10-19(11-13-20)15-16-6-3-2-4-7-16/h2-9,14H,10-13,15H2,1H3
InChIKey DABGEKAEKHHGFN-UHFFFAOYSA-N
Instrument Name HP 5970A
Ionization Type EI
Literature Reference DOI 10.1021/jm901689v
Molecular Weight 330.446 g/mol
SMILES c1c(cc(cc1)N1CCN(CC1)Cc1ccccc1)S(C)(=O)=O
SPLASH splash10-00kf-7903000000-928e68700cb0bbdbd0ea
Source of Spectrum AF-53-SM3-11a
Wiley ID 1846364