SpectraBase Spectrum ID |
K45aUsA6ACI |
Name |
10,10'-Trimethylenebis(3-methylisoalloxazine) |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
496.160751152 u |
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 |
Molecular Weight |
496.487 g/mol |
SMILES |
C(CCN1C=2C=CC=CC2N=C2C(N(C(N=C12)=O)C)=O)N1C=2C=CC=CC2N=C2C(N(C(N=C12)=O)C)=O |