| SpectraBase Spectrum ID |
6oIdTUkY4DB |
| Name |
Coumarin |
| Source of Sample |
SAFC Cat.no. W526509 |
| CAS Registry Number |
91-64-5 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
146.036779431 u |
| Formula |
C9H6O2 |
| InChI |
InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H |
| InChIKey |
ZYGHJZDHTFUPRJ-UHFFFAOYSA-N |
| Molecular Weight |
146.145 g/mol |
| Number of Peaks |
50 |
| RI1 |
1438 |
| RI2 |
1117 |
| RI3 |
1797 |
| RI4 |
1763 |
| RI5 |
1389 |
| SMILES |
C1(Oc2ccccc2C=C1)=O |
| SPLASH |
splash10-02td-9700000000-0f47fa046ec39b103036 |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
2H-1-Benzopyran-2-one |
| Wiley ID |
LM_FFNSC3_148 |
