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10-[3-(trifluoromethyl)phenyl]benzo[g]pteridine-2,4-dione
SpectraBase Compound ID 5USy9SebfsG
InChI InChI=1S/C17H9F3N4O2/c18-17(19,20)9-4-3-5-10(8-9)24-12-7-2-1-6-11(12)21-13-14(24)22-16(26)23-15(13)25/h1-8H,(H,23,25,26)
InChIKey XHAOLTQKNINZTF-UHFFFAOYSA-N
Mol Weight 358.28 g/mol
Molecular Formula C17H9F3N4O2
Exact Mass 358.06776 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSf0vr5g0C9
Name 10-[3-(trifluoromethyl)phenyl]benzo[g]pteridine-2,4-dione
Alternate Name(s) 10-[3-(trifluoromethyl)phenyl]benzo[g]pteridine-2,4-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H9F3N4O2
InChI InChI=1S/C17H9F3N4O2/c18-17(19,20)9-4-3-5-10(8-9)24-12-7-2-1-6-11(12)21-13-14(24)22-16(26)23-15(13)25/h1-8H,(H,23,25,26)
InChIKey XHAOLTQKNINZTF-UHFFFAOYSA-N
Molecular Weight 358.280 g/mol
SMILES N1C(C=2C(=NC1=O)N(c1c(N2)cccc1)c1cc(C(F)(F)F)ccc1)=O
SPLASH splash10-0a4r-0159000000-c81224aea6a834b13541
Source of Spectrum U-1995-1278-8
Wiley ID 767232