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2-[4-[4-[1-(1-Piperidinyl)cyclohexyl]phenyl]butyl]-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID FsG6vMxHfA5
InChI InChI=1S/C29H36N2O2/c32-27-25-12-3-4-13-26(25)28(33)31(27)22-10-5-11-23-14-16-24(17-15-23)29(18-6-1-7-19-29)30-20-8-2-9-21-30/h3-4,12-17H,1-2,5-11,18-22H2
InChIKey ZMAMAKNHSHDCCR-UHFFFAOYSA-N
Mol Weight 444.6 g/mol
Molecular Formula C29H36N2O2
Exact Mass 444.277678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5b5W2fLYR1k
Name 2-[4-[4-[1-(1-Piperidinyl)cyclohexyl]phenyl]butyl]-1H-isoindole-1,3(2H)-dione
CAS Registry Number 77415-88-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H36N2O2
InChI InChI=1S/C29H36N2O2/c32-27-25-12-3-4-13-26(25)28(33)31(27)22-10-5-11-23-14-16-24(17-15-23)29(18-6-1-7-19-29)30-20-8-2-9-21-30/h3-4,12-17H,1-2,5-11,18-22H2
InChIKey ZMAMAKNHSHDCCR-UHFFFAOYSA-N
Molecular Weight 444.619 g/mol
SMILES C1(N(C(c2ccccc12)=O)CCCCc1ccc(C2(N3CCCCC3)CCCCC2)cc1)=O
SPLASH splash10-0pbc-0005900000-aea29037dbb43b448287
Source of Spectrum J-46-2770-0
Wiley ID 1386149