SpectraBase Spectrum ID |
B0ZGu3gX5rP |
Name |
Salicylate |
Source of Sample |
SAFC Cat.no. W365009 |
CAS Registry Number |
2052-14-4 |
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 |
194.094294308 u |
Formula |
C11H14O3 |
InChI |
InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-6-4-5-7-10(9)12/h4-7,12H,2-3,8H2,1H3 |
InChIKey |
YFDUWSBGVPBWKF-UHFFFAOYSA-N |
Molecular Weight |
194.230 g/mol |
Number of Peaks |
50 |
RI1 |
1474 |
RI2 |
1152 |
RI3 |
1322 |
RI4 |
1281 |
RI5 |
1449 |
SMILES |
Oc1ccccc1C(OCCCC)=O |
SPLASH |
splash10-00di-4900000000-4a41b84bd0d37b99daa9 |
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-, butyl ester |
Wiley ID |
LM_FFNSC3_37 |