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Canthin-2,6-dione

View entire compound with spectra: 2 MS (GC)

Canthin-2,6-dione
SpectraBase Compound ID 7etJs16aIJt
InChI InChI=1S/C14H8N2O2/c17-12-7-9-8-3-1-2-4-11(8)16-13(18)6-5-10(15-12)14(9)16/h1-7H,(H,15,17)
InChIKey BDCOKQCMZJCYDY-UHFFFAOYSA-N
Mol Weight 236.23 g/mol
Molecular Formula C14H8N2O2
Exact Mass 236.058578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7JLg9tpUXcX
Name Canthin-2,6-dione
Alternate Name(s) 2-Hydroxycanthin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8N2O2
InChI InChI=1S/C14H8N2O2/c17-12-7-9-8-3-1-2-4-11(8)16-13(18)6-5-10(15-12)14(9)16/h1-7H,(H,15,17)
InChIKey BDCOKQCMZJCYDY-UHFFFAOYSA-N
Molecular Weight 236.230 g/mol
SMILES Oc1nc2c3[n](c4c(cccc4)c3c1)C(C=C2)=O
SPLASH splash10-052r-4390000000-1c81275cd3f0d8824ef6
Source of Spectrum X2-49-1013-4
Wiley ID 1602022