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4-(3-Hydroxy-3-trifluoromethyl-3,3A,4,5,6,7,8,9,10,11,12,13-dodecahydrocyclododeca[C]pyrazol-2-yl)-7-chloroquinoline
SpectraBase Compound ID 8aDiJmHvl7c
InChI InChI=1S/C23H27ClF3N3O/c24-16-11-12-17-20(15-16)28-14-13-21(17)30-22(31,23(25,26)27)18-9-7-5-3-1-2-4-6-8-10-19(18)29-30/h11-15,18,31H,1-10H2
InChIKey IPZWZSGLISPBDX-UHFFFAOYSA-N
Mol Weight 453.94 g/mol
Molecular Formula C23H27ClF3N3O
Exact Mass 453.179475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LbRgdSfWEOB
Name 4-(3-hydroxy-3-trifluoromethyl-3,3a,4,5,6,7,8,9,10,11,12,13-dodecahydrocyclododeca[c]pyrazol-2-yl)-7-chloroquinoline
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27ClF3N3O
InChI InChI=1S/C23H27ClF3N3O/c24-16-11-12-17-20(15-16)28-14-13-21(17)30-22(31,23(25,26)27)18-9-7-5-3-1-2-4-6-8-10-19(18)29-30/h11-15,18,31H,1-10H2
InChIKey IPZWZSGLISPBDX-UHFFFAOYSA-N
Molecular Weight 453.937 g/mol
SMILES OC1(N(N=C2C1CCCCCCCCCC2)c1c2c(cc(cc2)Cl)ncc1)C(F)(F)F
SPLASH splash10-000i-0207900000-af9fdd8e5acf261aa854
Source of Spectrum Y-46-162-5c
Synonyms 2-(7-Chloro-4-quinolinyl)-3-(trifluoromethyl)-4,5,6,7,8,9,10,11,12,13-decahydro-3aH-cyclododeca[c]pyrazol-3-ol 2-(7-Chloroquinolin-4-yl)-3-(trifluoromethyl)-4,5,6,7,8,9,10,11,12,13-decahydro-3aH-cyclododeca[c]pyrazol-3-ol 2-(7-Chloranylquinolin-4-yl)-3-(trifluoromethyl)-4,5,6,7,8,9,10,11,12,13-decahydro-3aH-cyclododeca[c]pyrazol-3-ol
Wiley ID 1666678