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2-[2-[4-[1-(1-Piperidinyl)cyclohexyl]phenyl]ethyl]-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID BDTiRzDiu1n
InChI InChI=1S/C27H32N2O2/c30-25-23-9-3-4-10-24(23)26(31)29(25)20-15-21-11-13-22(14-12-21)27(16-5-1-6-17-27)28-18-7-2-8-19-28/h3-4,9-14H,1-2,5-8,15-20H2
InChIKey ZKNHBMYPCXCONM-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C27H32N2O2
Exact Mass 416.246378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30GHG40RHP3
Name 2-[2-[4-[1-(1-Piperidinyl)cyclohexyl]phenyl]ethyl]-1H-isoindole-1,3(2H)-dione
CAS Registry Number 76916-26-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H32N2O2
InChI InChI=1S/C27H32N2O2/c30-25-23-9-3-4-10-24(23)26(31)29(25)20-15-21-11-13-22(14-12-21)27(16-5-1-6-17-27)28-18-7-2-8-19-28/h3-4,9-14H,1-2,5-8,15-20H2
InChIKey ZKNHBMYPCXCONM-UHFFFAOYSA-N
Molecular Weight 416.565 g/mol
SMILES C1(N(C(c2ccccc12)=O)CCc1ccc(C2(N3CCCCC3)CCCCC2)cc1)=O
SPLASH splash10-00si-0019300000-9dfdc1f98baafa683f37
Source of Spectrum J-46-2770-0
Wiley ID 1376568