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Pyrazolo[1,5-a]pyrimidine, 4,5,6,7-tetrahydro-5-(4-methoxyphenyl)-3-[(4-tricyclo[3.3.1.1(3,7)]dec-1-yl-1-piperazinyl)carbonyl]-7-(trifluoromethyl)-
SpectraBase Compound ID HabigCnZaK7
InChI InChI=1S/C29H36F3N5O2/c1-39-22-4-2-21(3-5-22)24-13-25(29(30,31)32)37-26(34-24)23(17-33-37)27(38)35-6-8-36(9-7-35)28-14-18-10-19(15-28)12-20(11-18)16-28/h2-5,17-20,24-25,34H,6-16H2,1H3
InChIKey KMHYZAIQYYMDLL-UHFFFAOYSA-N
Mol Weight 543.6 g/mol
Molecular Formula C29H36F3N5O2
Exact Mass 543.28211 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8wUfPI8QkMC
Name Pyrazolo[1,5-a]pyrimidine, 4,5,6,7-tetrahydro-5-(4-methoxyphenyl)-3-[(4-tricyclo[3.3.1.1(3,7)]dec-1-yl-1-piperazinyl)carbonyl]-7-(trifluoromethyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H36F3N5O2
InChI InChI=1S/C29H36F3N5O2/c1-39-22-4-2-21(3-5-22)24-13-25(29(30,31)32)37-26(34-24)23(17-33-37)27(38)35-6-8-36(9-7-35)28-14-18-10-19(15-28)12-20(11-18)16-28/h2-5,17-20,24-25,34H,6-16H2,1H3
InChIKey KMHYZAIQYYMDLL-UHFFFAOYSA-N
Molecular Weight 543.635 g/mol
SMILES N1C(CC([n]2c1c(cn2)C(N1CCN(C23CC4CC(C3)CC(C2)C4)CC1)=O)C(F)(F)F)c1ccc(cc1)OC
SPLASH splash10-000l-5921000000-c55a433d253c5abb5cfc
Source of Spectrum IY-1-4701-6
Wiley ID 1654999