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

*Links on SpectraBase are not permalinks.
{2-[1'-(Dimethylamino)methylene-3',3',3'-trifluoro-2'-oxopropyl]-1H-indol-3-yl}-acetonitrile
SpectraBase Compound ID 7rf4mKgS9Db
InChI InChI=1S/C16H14F3N3O/c1-22(2)9-12(15(23)16(17,18)19)14-11(7-8-20)10-5-3-4-6-13(10)21-14/h3-6,9,21H,7H2,1-2H3/b12-9-
InChIKey IMRQZKSFSLFMAD-XFXZXTDPSA-N
Mol Weight 321.3 g/mol
Molecular Formula C16H14F3N3O
Exact Mass 321.108897 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 CjWcUiGcksX
Name {2-[1'-(Dimethylamino)methylene-3',3',3'-trifluoro-2'-oxopropyl]-1H-indol-3-yl}-acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14F3N3O
InChI InChI=1S/C16H14F3N3O/c1-22(2)9-12(15(23)16(17,18)19)14-11(7-8-20)10-5-3-4-6-13(10)21-14/h3-6,9,21H,7H2,1-2H3/b12-9-
InChIKey IMRQZKSFSLFMAD-XFXZXTDPSA-N
Molecular Weight 321.303 g/mol
SMILES [nH]1c2ccccc2c(c1\C(C(C(F)(F)F)=O)=C\N(C)C)CC#N
SPLASH splash10-001i-0922000000-30b5ef318843d9b42fc0
Source of Spectrum AH-133-155-3
Synonyms {2-[(Z)-2-(dimethylamino)-1-(trifluoroacetyl)ethenyl]-1H-indol-3-yl}acetonitrile
Wiley ID 1546644