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

*Links on SpectraBase are not permalinks.
2-(2-Chlorophenyl)-2-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5(4H)-yl)acetic acid(3-bromopropanol)ester
SpectraBase Compound ID EhoLbgNvzFo
InChI InChI=1S/C18H19BrClNO2S/c19-8-3-10-23-18(22)17(14-4-1-2-5-15(14)20)21-9-6-16-13(12-21)7-11-24-16/h1-2,4-5,7,11,17H,3,6,8-10,12H2
InChIKey FMFKLJDIOGIGDS-UHFFFAOYSA-N
Mol Weight 428.77 g/mol
Molecular Formula C18H19BrClNO2S
Exact Mass 427.000841 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 Jz71KWzwCTk
Name 2-(2-Chlorophenyl)-2-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5(4H)-yl)acetic acid(3-bromopropanol)ester
Appearance Colorless transparent crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19BrClNO2S
InChI InChI=1S/C18H19BrClNO2S/c19-8-3-10-23-18(22)17(14-4-1-2-5-15(14)20)21-9-6-16-13(12-21)7-11-24-16/h1-2,4-5,7,11,17H,3,6,8-10,12H2
InChIKey FMFKLJDIOGIGDS-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 428.772 g/mol
SMILES c12CN(CCc2scc1)C(C(OCCCBr)=O)c1ccccc1Cl
SPLASH splash10-03di-0290000000-33d898e4982f595c1443
Source of Spectrum CN101863900A
Wiley ID 1843881