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GUSANLUNG-B
SpectraBase Compound ID H5R10aroubQ
InChI InChI=1S/C20H19NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,8-9,14H,5-7,10H2,1-2H3
InChIKey DESORMZUMYIKSG-UHFFFAOYSA-N
Mol Weight 353.37 g/mol
Molecular Formula C20H19NO5
Exact Mass 353.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lw7DWUDyKaR
Name 8-Oxocanadine
CAS Registry Number 79027-73-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO5
InChI InChI=1S/C20H19NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,8-9,14H,5-7,10H2,1-2H3
InChIKey DESORMZUMYIKSG-UHFFFAOYSA-N
Molecular Weight 353.374 g/mol
SMILES C1(N2C(c3cc4OCOc4cc3CC2)Cc2c1c(c(cc2)OC)OC)=O
SPLASH splash10-004i-2901000000-583afdf833e81f15b53f
Source of Spectrum J-64-6596-23
Synonyms (+-)-8-Oxocanadine
Wiley ID 1530948