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(3R*,3aS*,7aS*)-1-(2-Methoxybenzyl)-3-phenylperhydro-4,7-ethanopyrrolo[3,2-b]pyridine
SpectraBase Compound ID 8SY5QvVbhJK
InChI InChI=1S/C23H28N2O/c1-26-21-10-6-5-9-19(21)15-25-16-20(17-7-3-2-4-8-17)23-22(25)18-11-13-24(23)14-12-18/h2-10,18,20,22-23H,11-16H2,1H3/t20-,22-,23-/m0/s1
InChIKey SRMURQUSDSGDPW-PMVMPFDFSA-N
Mol Weight 348.49 g/mol
Molecular Formula C23H28N2O
Exact Mass 348.220164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WYRFSyvcBj
Name (3R*,3aS*,7aS*)-1-(2-Methoxybenzyl)-3-phenylperhydro-4,7-ethanopyrrolo[3,2-b]pyridine
Alternate Name(s) (2S,3R,6S)-5-(2-methoxybenzyl)-3-phenyl-1,5-diazatricyclo[5.2.2.0(2,6)]undecane methyl 2-{[(2S,3R,6S)-3-phenyl-1,5-diazatricyclo[5.2.2.0(2,6)]undec-5-yl]methyl}phenyl ether
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28N2O
InChI InChI=1S/C23H28N2O/c1-26-21-10-6-5-9-19(21)15-25-16-20(17-7-3-2-4-8-17)23-22(25)18-11-13-24(23)14-12-18/h2-10,18,20,22-23H,11-16H2,1H3/t20-,22-,23-/m0/s1
InChIKey SRMURQUSDSGDPW-PMVMPFDFSA-N
Molecular Weight 348.490 g/mol
SMILES [C@@]12(N(C[C@]([C@@]2(N2CCC1CC2)[H])(c1ccccc1)[H])Cc1c(OC)cccc1)[H]
SPLASH splash10-004j-0095000000-7ad11b2f96c9504791af
Source of Spectrum KC-0-473-29
Wiley ID 783071