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2-Benzyl-3,4,4a,5,6,7-hexahydro-6-hydroxy-7-(1-pyrrolidinyl)-1(2H)-isoquinolinone

View entire compound with spectra: 1 MS (GC)

2-Benzyl-3,4,4a,5,6,7-hexahydro-6-hydroxy-7-(1-pyrrolidinyl)-1(2H)-isoquinolinone
SpectraBase Compound ID DR93vpYl3F7
InChI InChI=1S/C20H26N2O2/c23-19-12-16-8-11-22(14-15-6-2-1-3-7-15)20(24)17(16)13-18(19)21-9-4-5-10-21/h1-3,6-7,13,16,18-19,23H,4-5,8-12,14H2
InChIKey RHMCEDJGHJPGAL-UHFFFAOYSA-N
Mol Weight 326.44 g/mol
Molecular Formula C20H26N2O2
Exact Mass 326.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbRg1R9g4ig
Name 2-Benzyl-3,4,4a,5,6,7-hexahydro-6-hydroxy-7-(1-pyrrolidinyl)-1(2H)-isoquinolinone
Alternate Name(s) 2-Benzyl-6-hydroxy-7-(1-pyrrolidinyl)-3,4,4a,5,6,7-hexahydro-1(2H)-isoquinolinone
CAS Registry Number 114431-52-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N2O2
InChI InChI=1S/C20H26N2O2/c23-19-12-16-8-11-22(14-15-6-2-1-3-7-15)20(24)17(16)13-18(19)21-9-4-5-10-21/h1-3,6-7,13,16,18-19,23H,4-5,8-12,14H2
InChIKey RHMCEDJGHJPGAL-UHFFFAOYSA-N
Molecular Weight 326.440 g/mol
SMILES OC1CC2C(C(N(Cc3ccccc3)CC2)=O)=CC1N1CCCC1
SPLASH splash10-000x-8694000000-fe9a4d655b1c1a18bda4
Source of Spectrum AJ-60-3266-19
Wiley ID 1325041