| SpectraBase Spectrum ID |
ECEbXfJDEY0 |
| Name |
N-(Phenoxycarbonyl)-8-caffeinamine |
| Alternate Name(s) |
phenyl 1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-ylcarbamate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H15N5O4 |
| InChI |
InChI=1S/C15H15N5O4/c1-18-10-11(19(2)15(23)20(3)12(10)21)16-13(18)17-14(22)24-9-7-5-4-6-8-9/h4-8H,1-3H3,(H,16,17,22) |
| InChIKey |
SUNKOJHTIOAPNW-UHFFFAOYSA-N |
| Molecular Weight |
329.316 g/mol |
| SMILES |
N(c1nc2c(C(=O)N(C(N2C)=O)C)[n]1C)C(Oc1ccccc1)=O |
| SPLASH |
splash10-016r-9008000000-8b52456d00f39987a77c |
| Source of Spectrum |
Y-32-945-16 |
| Wiley ID |
1326980 |
