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N-Benzyl-N-norallocryptopine

View entire compound with spectra: 1 MS (GC)

N-Benzyl-N-norallocryptopine
SpectraBase Compound ID CWpcceVybnL
InChI InChI=1S/C27H27NO5/c1-30-24-9-8-19-12-23(29)21-14-26-25(32-17-33-26)13-20(21)10-11-28(16-22(19)27(24)31-2)15-18-6-4-3-5-7-18/h3-9,13-14H,10-12,15-17H2,1-2H3
InChIKey XEXCJRMCALAGQQ-UHFFFAOYSA-N
Mol Weight 445.52 g/mol
Molecular Formula C27H27NO5
Exact Mass 445.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3QGozgXRlcF
Name N-Benzyl-N-norallocryptopine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H27NO5
InChI InChI=1S/C27H27NO5/c1-30-24-9-8-19-12-23(29)21-14-26-25(32-17-33-26)13-20(21)10-11-28(16-22(19)27(24)31-2)15-18-6-4-3-5-7-18/h3-9,13-14H,10-12,15-17H2,1-2H3
InChIKey XEXCJRMCALAGQQ-UHFFFAOYSA-N
Molecular Weight 445.515 g/mol
SMILES c12c(CC(c3cc4OCOc4cc3CCN(C2)Cc2ccccc2)=O)ccc(c1OC)OC
SPLASH splash10-0006-9601000000-f060d6cd625598c9d7a4
Source of Spectrum K1-0-968-7
Wiley ID 1588478