| SpectraBase Spectrum ID |
JiMQFBf19CZ |
| Name |
Coumarin <3-methyl-> |
| CAS Registry Number |
2445-82-1 |
| 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 |
160.052429496 u |
| Formula |
C10H8O2 |
| InChI |
InChI=1S/C10H8O2/c1-7-6-8-4-2-3-5-9(8)12-10(7)11/h2-6H,1H3 |
| InChIKey |
VIIIJFZJKFXOGG-UHFFFAOYSA-N |
| Molecular Weight |
160.172 g/mol |
| Number of Peaks |
45 |
| RI1 |
1497 |
| SMILES |
CC1=Cc2c(cccc2)OC1=O |
| SPLASH |
splash10-01q9-6900000000-ab0e6c1a8d73f2dba8da |
| 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, 3-methyl- |
| Wiley ID |
LM_FFNSC3_2663 |
