| SpectraBase Spectrum ID |
Ba72mXg7OHY |
| Name |
Salicylate |
| Source of Sample |
SAFC Cat.no. W520306 |
| CAS Registry Number |
6259-76-3 |
| 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 |
222.125594437 u |
| Formula |
C13H18O3 |
| InChI |
InChI=1S/C13H18O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h5-6,8-9,14H,2-4,7,10H2,1H3 |
| InChIKey |
DUKPKQFHJQGTGU-UHFFFAOYSA-N |
| Molecular Weight |
222.284 g/mol |
| Number of Peaks |
50 |
| RI1 |
1679 |
| RI2 |
1356 |
| RI3 |
1578 |
| RI4 |
1542 |
| RI5 |
1467 |
| SMILES |
Oc1c(cccc1)C(OCCCCCC)=O |
| SPLASH |
splash10-00di-6900000000-f09b1ea0c81b6a1d77b8 |
| 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 |
Benzoic acid, 2-hydroxy-, hexyl ester |
| Wiley ID |
LM_FFNSC3_449 |
