| SpectraBase Spectrum ID |
KWotcNVUbsc |
| Name |
8-BENZOYLCAFFEINE |
| Source of Sample |
T. Itahara, Kagoshima University, Kagoshima, Japan |
| Copyright |
Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H14N4O3 |
| InChI |
InChI=1S/C15H14N4O3/c1-17-10-12(18(2)15(22)19(3)14(10)21)16-13(17)11(20)9-7-5-4-6-8-9/h4-8H,1-3H3 |
| InChIKey |
RLIJLUKTZNBAJG-UHFFFAOYSA-N |
| Literature Reference |
CHEM. LETTERS 1985, 1441
Abstract-Chemical Abstracts= 105, 78895B(1986) |
| Melting Point |
172.5-173.5C |
| Molecular Weight |
298.302002 |
| Synonyms |
CAFFEINE, 8-BENZOYL-, |
| Technique |
KBr WAFER |
