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Octaverine

View entire compound with spectra: 1 MS (GC)

Octaverine
SpectraBase Compound ID HFgdvG9VNqm
InChI InChI=1S/C23H27NO5/c1-6-27-20-12-16(13-21(28-7-2)23(20)29-8-3)22-17-14-19(26-5)18(25-4)11-15(17)9-10-24-22/h9-14H,6-8H2,1-5H3
InChIKey NGIFHAUKQGDVSR-UHFFFAOYSA-N
Mol Weight 397.47 g/mol
Molecular Formula C23H27NO5
Exact Mass 397.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 17g3gIZkZTb
Name Octaverine
Alternate Name(s) 6,7-Dimethoxy-1-(3,4,5-triethoxyphenyl)isoquinolin Isoquinoline, 6,7-dimethoxy-1-(3,4,5-triethoxyphenyl)- Octaverina Octaverinum Oktaverine Ottaverina EINECS 208-976-1
CAS Registry Number 549-68-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27NO5
InChI InChI=1S/C23H27NO5/c1-6-27-20-12-16(13-21(28-7-2)23(20)29-8-3)22-17-14-19(26-5)18(25-4)11-15(17)9-10-24-22/h9-14H,6-8H2,1-5H3
InChIKey NGIFHAUKQGDVSR-UHFFFAOYSA-N
Molecular Weight 397.471 g/mol
SMILES COc1cc2c(nccc2cc1OC)-c1cc(OCC)c(OCC)c(c1)OCC
SPLASH splash10-0002-0019000000-1b54219ebcdacdfa4a95
Source of Spectrum JZ-1992-1816-0
Wiley ID 1368019