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(2,6-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-[5-phenyl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinyl]methanone

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(2,6-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-[5-phenyl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinyl]methanone
SpectraBase Compound ID JNTlKGpodWx
InChI InChI=1S/C25H27F3N4O/c1-15-8-11-21-18(12-15)10-9-16(2)31(21)24(33)20-14-23-29-19(17-6-4-3-5-7-17)13-22(25(26,27)28)32(23)30-20/h3-7,13-16,18,21H,8-12H2,1-2H3
InChIKey MXFPPEOATZCSBR-UHFFFAOYSA-N
Mol Weight 456.51 g/mol
Molecular Formula C25H27F3N4O
Exact Mass 456.213696 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GmujxrJ5i13
Name (2,6-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-[5-phenyl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinyl]methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27F3N4O
InChI InChI=1S/C25H27F3N4O/c1-15-8-11-21-18(12-15)10-9-16(2)31(21)24(33)20-14-23-29-19(17-6-4-3-5-7-17)13-22(25(26,27)28)32(23)30-20/h3-7,13-16,18,21H,8-12H2,1-2H3
InChIKey MXFPPEOATZCSBR-UHFFFAOYSA-N
Molecular Weight 456.513 g/mol
SMILES C=1(C=C([n]2c(N1)cc(n2)C(N1C2C(CC(CC2)C)CCC1C)=O)C(F)(F)F)c1ccccc1
SPLASH splash10-014i-3922100000-5f2cf243d4d2a16d7982
Synonyms (2,6-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone
Wiley ID 1447918