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10,10'-Trimethylenebis(3-methylisoalloxazine)
SpectraBase Compound ID LDKqJoizysA
InChI InChI=1S/C25H20N8O4/c1-30-22(34)18-20(28-24(30)36)32(16-10-5-3-8-14(16)26-18)12-7-13-33-17-11-6-4-9-15(17)27-19-21(33)29-25(37)31(2)23(19)35/h3-6,8-11H,7,12-13H2,1-2H3
InChIKey ODFQAMNENWXQST-UHFFFAOYSA-N
Mol Weight 496.49 g/mol
Molecular Formula C25H20N8O4
Exact Mass 496.160751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZ4cm6ABf4A
Name 10,10'-Trimethylenebis(3-methylisoalloxazine)
Alternate Name(s) 10,10'-(propane-1,3-diyl)bis(3-methylbenzo[g]pteridine-2,4(3H,10H)-dione)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20N8O4
InChI InChI=1S/C25H20N8O4/c1-30-22(34)18-20(28-24(30)36)32(16-10-5-3-8-14(16)26-18)12-7-13-33-17-11-6-4-9-15(17)27-19-21(33)29-25(37)31(2)23(19)35/h3-6,8-11H,7,12-13H2,1-2H3
InChIKey ODFQAMNENWXQST-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19941270917
Molecular Weight 496.487 g/mol
SMILES C(CCN1c2ccccc2N=C2C(N(C(N=C12)=O)C)=O)N1c2ccccc2N=C2C(N(C(N=C12)=O)C)=O
SPLASH splash10-00wc-0980200000-7e7dbe7f9cd95b399c8b
Source of Spectrum K-127-1661-12
Wiley ID 1792389