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

*Links on SpectraBase are not permalinks.
1-[(4-oxo-4,5,6,7-tetrahydrobenzo[b]thiophen-6-yl)methyl]-4-(2'-pyridyl)piperazine
SpectraBase Compound ID 6TZnJTD4p92
InChI InChI=1S/C18H21N3OS/c22-16-11-14(12-17-15(16)4-10-23-17)13-20-6-8-21(9-7-20)18-3-1-2-5-19-18/h1-5,10,14H,6-9,11-13H2
InChIKey JCHGHOIRBKRLFX-UHFFFAOYSA-N
Mol Weight 327.45 g/mol
Molecular Formula C18H21N3OS
Exact Mass 327.140533 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 ppLaAfFg
Name 1-[(4-oxo-4,5,6,7-tetrahydrobenzo[b]thiophen-6-yl)methyl]-4-(2'-pyridyl)piperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21N3OS
InChI InChI=1S/C18H21N3OS/c22-16-11-14(12-17-15(16)4-10-23-17)13-20-6-8-21(9-7-20)18-3-1-2-5-19-18/h1-5,10,14H,6-9,11-13H2
InChIKey JCHGHOIRBKRLFX-UHFFFAOYSA-N
Instrument Name Micromass QMD 1000
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19980630)12_12_793
Molecular Weight 327.446 g/mol
SMILES c12C(CC(Cc2scc1)CN1CCN(CC1)c1ccccn1)=O
SPLASH splash10-0ae9-1931000000-ff0c4ef0098a8e567456
Source of Spectrum RCM-12-794-1
Wiley ID 1836138