SpectraBase Spectrum ID |
3FIyPtXcqK7 |
Name |
Xanthine, 8-[4-[(hydrazinocarbonyl)methoxy]phenyl]-1,3-dipropyl- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
400.185903273 u |
Formula |
C19H24N6O4 |
InChI |
InChI=1S/C19H24N6O4/c1-3-9-24-17-15(18(27)25(10-4-2)19(24)28)21-16(22-17)12-5-7-13(8-6-12)29-11-14(26)23-20/h5-8H,3-4,9-11,20H2,1-2H3,(H,21,22)(H,23,26) |
InChIKey |
IBDKKSRMRJMAGL-UHFFFAOYSA-N |
Molecular Weight |
400.439 g/mol |
SMILES |
C12=C(C(N(C(N2CCC)=O)CCC)=O)N=C(N1)C1=CC=C(C=C1)OCC(NN)=O |