| SpectraBase Spectrum ID |
7JEZp2zgPVA |
| Name |
Vanillin |
| Source of Sample |
SAFC Cat.no. W310700 |
| CAS Registry Number |
121-33-5 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
152.047344115 u |
| Formula |
C8H8O3 |
| InChI |
InChI=1S/C8H8O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-5,10H,1H3 |
| InChIKey |
MWOOGOJBHIARFG-UHFFFAOYSA-N |
| Molecular Weight |
152.149 g/mol |
| Number of Peaks |
50 |
| RI1 |
1394 |
| RI2 |
1073 |
| RI3 |
1918 |
| RI4 |
1885 |
| SMILES |
Oc1ccc(cc1OC)C=O |
| SPLASH |
splash10-0udi-6900000000-dbeebd01b15fa770bca2 |
| 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 |
Benzaldehyde, 4-hydroxy-3-methoxy- |
| Wiley ID |
LM_FFNSC3_420 |
