| SpectraBase Spectrum ID |
EWMLUdJoI15 |
| Name |
8-(1,2-Dimethoxyethyl)caffeine |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18N4O4 |
| InChI |
InChI=1S/C12H18N4O4/c1-14-8-10(13-9(14)7(20-5)6-19-4)15(2)12(18)16(3)11(8)17/h7H,6H2,1-5H3 |
| InChIKey |
LQIGIILQORFECS-UHFFFAOYSA-N |
| Molecular Weight |
282.300 g/mol |
| SMILES |
c12c(N(C)C(N(C2=O)C)=O)nc([n]1C)C(OC)COC |
| SPLASH |
splash10-000i-0090000000-896e5602dc44769a0b3e |
| Source of Spectrum |
AJ-65-2048-5 |
| Synonyms |
8-(1,2-dimethoxyethyl)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Wiley ID |
771493 |
