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Bis-nor-thalrugosine

View entire compound with spectra: 1 MS (GC)

Bis-nor-thalrugosine
SpectraBase Compound ID JRVckKZR36h
InChI InChI=1S/C35H36N2O6/c1-39-28-9-6-21-15-27-33-23(11-13-37-27)18-32(41-3)34(38)35(33)43-31-19-25-22(17-29(31)40-2)10-12-36-26(25)14-20-4-7-24(8-5-20)42-30(28)16-21/h4-9,16-19,26-27,36-38H,10-15H2,1-3H3
InChIKey HHIPEIMGSFBTCV-UHFFFAOYSA-N
Mol Weight 580.7 g/mol
Molecular Formula C35H36N2O6
Exact Mass 580.257337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ue2ojofdF0
Name Bis-nor-thalrugosine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H36N2O6
InChI InChI=1S/C35H36N2O6/c1-39-28-9-6-21-15-27-33-23(11-13-37-27)18-32(41-3)34(38)35(33)43-31-19-25-22(17-29(31)40-2)10-12-36-26(25)14-20-4-7-24(8-5-20)42-30(28)16-21/h4-9,16-19,26-27,36-38H,10-15H2,1-3H3
InChIKey HHIPEIMGSFBTCV-UHFFFAOYSA-N
Molecular Weight 580.681 g/mol
SMILES N1CCc2c3c(c(c(c2)OC)O)Oc2cc4C(Cc5ccc(Oc6cc(CC13)ccc6OC)cc5)NCCc4cc2OC
SPLASH splash10-0udi-0609010000-83c0209e485312e31c76
Source of Spectrum X2-50-379-5
Wiley ID 1602228