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

*Links on SpectraBase are not permalinks.
9-(2-Thienyl)-6-[3-(trifluoromethyl)phenyl]-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
SpectraBase Compound ID 1azh5EE0iuH
InChI InChI=1S/C24H19F3N2OS/c25-24(26,27)16-6-3-5-14(11-16)23-22-19(28-17-7-1-2-8-18(17)29-23)12-15(13-20(22)30)21-9-4-10-31-21/h1-11,15,23,28-29H,12-13H2
InChIKey WUMXPTFQJQQTPD-UHFFFAOYSA-N
Mol Weight 440.48 g/mol
Molecular Formula C24H19F3N2OS
Exact Mass 440.117019 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 8xhOLo0DAEd
Name 9-(2-Thienyl)-6-[3-(trifluoromethyl)phenyl]-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H19F3N2OS
InChI InChI=1S/C24H19F3N2OS/c25-24(26,27)16-6-3-5-14(11-16)23-22-19(28-17-7-1-2-8-18(17)29-23)12-15(13-20(22)30)21-9-4-10-31-21/h1-11,15,23,28-29H,12-13H2
InChIKey WUMXPTFQJQQTPD-UHFFFAOYSA-N
Molecular Weight 440.484 g/mol
SMILES N1c2ccccc2NC(C2=C1CC(CC2=O)c1sccc1)c1cc(C(F)(F)F)ccc1
SPLASH splash10-0002-3981100000-5e6a193a21aafc2cc678
Synonyms 9-Thiophen-2-yl-6-[3-(trifluoromethyl)phenyl]-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Wiley ID 1455291