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Neosutchuenenine

View entire compound with spectra: 2 NMR, and 1 MS (GC)

Neosutchuenenine
SpectraBase Compound ID AO8VnEZFZAR
InChI InChI=1S/C36H40N2O6/c1-37-14-12-25-19-35(43-4)36(21-28(25)29(37)15-22-5-8-26(39)9-6-22)44-33-10-7-23(17-31(33)40)16-30-27-20-32(41)34(42-3)18-24(27)11-13-38(30)2/h5-10,17-21,29-30,39-41H,11-16H2,1-4H3
InChIKey MXVKZTHARDQLEC-UHFFFAOYSA-N
Mol Weight 596.7 g/mol
Molecular Formula C36H40N2O6
Exact Mass 596.288637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J6NOkwAOoIT
Name Neosutchuenenine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H40N2O6
InChI InChI=1S/C36H40N2O6/c1-37-14-12-25-19-35(43-4)36(21-28(25)29(37)15-22-5-8-26(39)9-6-22)44-33-10-7-23(17-31(33)40)16-30-27-20-32(41)34(42-3)18-24(27)11-13-38(30)2/h5-10,17-21,29-30,39-41H,11-16H2,1-4H3
InChIKey MXVKZTHARDQLEC-UHFFFAOYSA-N
Molecular Weight 596.724 g/mol
SMILES Oc1cc2C(Cc3cc(c(cc3)Oc3c(cc4CCN(C(c4c3)Cc3ccc(cc3)O)C)OC)O)N(CCc2cc1OC)C
SPLASH splash10-0007-0980100000-21ae79e27297fedee228
Source of Spectrum G4-60-944-420
Wiley ID 1606869