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1-Benzyl-7a-(3'-methoxyphenyl)-octahydroindole

View entire compound with spectra: 1 MS (GC)

1-Benzyl-7a-(3'-methoxyphenyl)-octahydroindole
SpectraBase Compound ID IkhsMFf6144
InChI InChI=1S/C22H27NO/c1-24-21-12-7-11-20(16-21)22-14-6-5-10-19(22)13-15-23(22)17-18-8-3-2-4-9-18/h2-4,7-9,11-12,16,19H,5-6,10,13-15,17H2,1H3
InChIKey CZXAVOHQAPBCLW-UHFFFAOYSA-N
Mol Weight 321.46 g/mol
Molecular Formula C22H27NO
Exact Mass 321.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kmttmG1SgX
Name 1-Benzyl-7a-(3'-methoxyphenyl)-octahydroindole
Alternate Name(s) 1-Benzyl-7a-(3-methoxyphenyl)octahydro-1H-indole 3-(1-benzyloctahydro-7aH-indol-7a-yl)phenyl methyl ether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO
InChI InChI=1S/C22H27NO/c1-24-21-12-7-11-20(16-21)22-14-6-5-10-19(22)13-15-23(22)17-18-8-3-2-4-9-18/h2-4,7-9,11-12,16,19H,5-6,10,13-15,17H2,1H3
InChIKey CZXAVOHQAPBCLW-UHFFFAOYSA-N
Molecular Weight 321.464 g/mol
SMILES C12(N(CCC2CCCC1)Cc1ccccc1)c1cc(OC)ccc1
SPLASH splash10-004i-0093000000-dd2d47e1a907ac004a00
Source of Spectrum SB-135-573-15
Wiley ID 1576526