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

*Links on SpectraBase are not permalinks.
2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 7-(difluoromethyl)-5-(2-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
SpectraBase Compound ID 8EduncIQ7Us
InChI InChI=1S/C25H28F2N4O3/c1-33-22-10-3-2-8-17(22)19-13-21(23(26)27)31-24(29-19)18(14-28-31)25(32)34-15-16-7-6-12-30-11-5-4-9-20(16)30/h2-3,8,10,13-14,16,20,23H,4-7,9,11-12,15H2,1H3
InChIKey VGDAQBDEZHYPBP-UHFFFAOYSA-N
Mol Weight 470.52 g/mol
Molecular Formula C25H28F2N4O3
Exact Mass 470.212947 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 FmfN6tWfmW
Name 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 7-(difluoromethyl)-5-(2-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28F2N4O3
InChI InChI=1S/C25H28F2N4O3/c1-33-22-10-3-2-8-17(22)19-13-21(23(26)27)31-24(29-19)18(14-28-31)25(32)34-15-16-7-6-12-30-11-5-4-9-20(16)30/h2-3,8,10,13-14,16,20,23H,4-7,9,11-12,15H2,1H3
InChIKey VGDAQBDEZHYPBP-UHFFFAOYSA-N
Molecular Weight 470.521 g/mol
SMILES c12[n](C(C(F)F)=CC(=N2)c2c(OC)cccc2)ncc1C(OCC1C2N(CCCC2)CCC1)=O
SPLASH splash10-0udi-2900000000-ed95d9b2670d63d18901
Synonyms 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 7-[bis(fluoranyl)methyl]-5-(2-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate 7-(difluoromethyl)-5-(2-methoxyphenyl)-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl ester 7-(difluoromethyl)-5-(2-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid quinolizidin-1-ylmethyl ester Octahydro-2H-quinolizin-1-ylmethyl 7-(difluoromethyl)-5-(2-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Wiley ID 1443304