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

*Links on SpectraBase are not permalinks.
3-[4-(4-Chlorophenyl)-2-phenylbut-3-yn-2-yl]-1-methyl-1H-indole
SpectraBase Compound ID AhgwZop2kXS
InChI InChI=1S/C25H20ClN/c1-25(20-8-4-3-5-9-20,17-16-19-12-14-21(26)15-13-19)23-18-27(2)24-11-7-6-10-22(23)24/h3-15,18H,1-2H3
InChIKey HSWNOMNBDSNYNO-UHFFFAOYSA-N
Mol Weight 369.9 g/mol
Molecular Formula C25H20ClN
Exact Mass 369.128427 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 4qPUMl1rYed
Name 3-[4-(4-Chlorophenyl)-2-phenylbut-3-yn-2-yl]-1-methyl-1H-indole
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20ClN
InChI InChI=1S/C25H20ClN/c1-25(20-8-4-3-5-9-20,17-16-19-12-14-21(26)15-13-19)23-18-27(2)24-11-7-6-10-22(23)24/h3-15,18H,1-2H3
InChIKey HSWNOMNBDSNYNO-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.7.89
Molecular Weight 369.895 g/mol
Reported Formula C25H20ClN
SMILES c1ccc2[n](cc(C(C#Cc3ccc(cc3)Cl)(c3ccccc3)C)c2c1)C
SPLASH splash10-0uxr-0009000000-05c5303b773dda80653c
Source of Spectrum BJO-7-SM4-1h
Thin-Layer Chromatography Rf = 0.25 (hexane/AcOEt, 10:1)
Wiley ID 1867239