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Cyclopenta[b]-1,2,3-triazolo[4,5-e]pyridin-8(1H)-one, 4,5,6,7-tetrahydro-4-[3-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 7XdY16sdqRK
InChI InChI=1S/C15H11F3N4O/c16-15(17,18)8-3-1-4-9(7-8)22-11-6-2-5-10(11)13(23)12-14(22)20-21-19-12/h1,3-4,7H,2,5-6H2,(H,19,20,21)
InChIKey VUVBFNLGCCFFTK-UHFFFAOYSA-N
Mol Weight 320.28 g/mol
Molecular Formula C15H11F3N4O
Exact Mass 320.088495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dwr6FZGhdBe
Name Cyclopenta[b]-1,2,3-triazolo[4,5-e]pyridin-8(1H)-one, 4,5,6,7-tetrahydro-4-[3-(trifluoromethyl)phenyl]-
CAS Registry Number 129609-36-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11F3N4O
InChI InChI=1S/C15H11F3N4O/c16-15(17,18)8-3-1-4-9(7-8)22-11-6-2-5-10(11)13(23)12-14(22)20-21-19-12/h1,3-4,7H,2,5-6H2,(H,19,20,21)
InChIKey VUVBFNLGCCFFTK-UHFFFAOYSA-N
Molecular Weight 320.275 g/mol
SMILES [nH]1nnc2c1C(C1=C(N2c2cc(C(F)(F)F)ccc2)CCC1)=O
SPLASH splash10-006x-0198000000-0df75578b084eb18f910
Source of Spectrum Y-27-1140-9
Synonyms 4-(3-Trifluoromethylphenyl)-8-oxo-4,5,6,7-tetrahydrocyclopenta[b]-1,2,3-triazolo[4,5-e]pyridine 4-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydrocyclopenta[b][1,2,3]triazolo[4,5-e]pyridin-8(1H)-one
Wiley ID 1319816