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Brucine
SpectraBase Compound ID 31paGroJ0TN
InChI InChI=1S/C23H26N2O4/c1-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3
InChIKey RRKTZKIUPZVBMF-UHFFFAOYSA-N
Mol Weight 394.47 g/mol
Molecular Formula C23H26N2O4
Exact Mass 394.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Vwa4rCN9vT
Name Strychnidin-10-one, 2,3-dimethoxy-
CAS Registry Number 357-57-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26N2O4
InChI InChI=1S/C23H26N2O4/c1-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3
InChIKey RRKTZKIUPZVBMF-UHFFFAOYSA-N
Molecular Weight 394.471 g/mol
SMILES C123C4N(C(=O)CC5C4C4CC1N(CC4=CCO5)CC2)c1c3cc(OC)c(c1)OC
SPLASH splash10-0006-3619000000-003955bde70d5f59bd9e
Source of Spectrum W5-33298-32238-32238
Synonyms 2,3-Dimethoxystrychnidin-10-one (-)-Brucine 10,11-Dimethoxystrychnine 10,11-Dimethystrychnine 2,3-Dimethoxy-strychnine 2,3-Dimethoxystrychnidine-10-one Brucin Brucina Brucine alkaloid Brucinum Bruzin Dimethoxy strychnine L-Brucine Strychnine, 2,3-dimethoxy- CCRIS 4754 EINECS 206-614-7 HSDB 307 RCRA WASTE NO. P018 UN1570
Wiley ID 1366715