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

*Links on SpectraBase are not permalinks.
5-Benzoyl-6-trifluoromethyl-1,2-dihydro-3H-pyrrolo[1,2-a]pyrrole-1-carboxylic acid isopropyl ester
SpectraBase Compound ID FBbgpTDt4qN
InChI InChI=1S/C19H18F3NO3/c1-11(2)26-18(25)13-8-9-23-15(13)10-14(19(20,21)22)16(23)17(24)12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3
InChIKey PTDYEXZMWVDAQK-UHFFFAOYSA-N
Mol Weight 365.35 g/mol
Molecular Formula C19H18F3NO3
Exact Mass 365.123878 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 6HLrpbxINsJ
Name 5-Benzoyl-6-trifluoromethyl-1,2-dihydro-3H-pyrrolo[1,2-a]pyrrole-1-carboxylic acid isopropyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18F3NO3
InChI InChI=1S/C19H18F3NO3/c1-11(2)26-18(25)13-8-9-23-15(13)10-14(19(20,21)22)16(23)17(24)12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3
InChIKey PTDYEXZMWVDAQK-UHFFFAOYSA-N
Molecular Weight 365.352 g/mol
SMILES c12[n](CCC2C(=O)OC(C)C)c(c(c1)C(F)(F)F)C(c1ccccc1)=O
SPLASH splash10-004i-3393000000-50fe6e40d7ff68c360c5
Source of Spectrum O1-63-2076-12
Synonyms isopropyl 5-benzoyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrrolo[1,2-a]pyrrole-1-carboxylate
Wiley ID 1592792