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

*Links on SpectraBase are not permalinks.
Furo[3,4-b]pyridine-2,5(1H,3H)-dione, 4-(1,3-benzodioxol-5-yl)-4,7-dihydro-1-[4-(trifluoromethyl)phenyl]-
SpectraBase Compound ID LA0Lm989X8K
InChI InChI=1S/C21H14F3NO5/c22-21(23,24)12-2-4-13(5-3-12)25-15-9-28-20(27)19(15)14(8-18(25)26)11-1-6-16-17(7-11)30-10-29-16/h1-7,14H,8-10H2
InChIKey ODNNZQFYWMWKNM-UHFFFAOYSA-N
Mol Weight 417.34 g/mol
Molecular Formula C21H14F3NO5
Exact Mass 417.082407 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 BTqJpvloctb
Name Furo[3,4-b]pyridine-2,5(1H,3H)-dione, 4-(1,3-benzodioxol-5-yl)-4,7-dihydro-1-[4-(trifluoromethyl)phenyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14F3NO5
InChI InChI=1S/C21H14F3NO5/c22-21(23,24)12-2-4-13(5-3-12)25-15-9-28-20(27)19(15)14(8-18(25)26)11-1-6-16-17(7-11)30-10-29-16/h1-7,14H,8-10H2
InChIKey ODNNZQFYWMWKNM-UHFFFAOYSA-N
Molecular Weight 417.340 g/mol
SMILES C1Oc2c(ccc(C3C4=C(N(C(C3)=O)c3ccc(cc3)C(F)(F)F)COC4=O)c2)O1
SPLASH splash10-0002-8912100000-d078e8b7d071626cb4d7
Source of Spectrum IY-1-4682-1
Synonyms 4-(1,3-benzodioxol-5-yl)-1-[4-(trifluoromethyl)phenyl]-4,7-dihydro-3H-furo[3,4-b]pyridine-2,5-dione
Wiley ID 1654804