| SpectraBase Spectrum ID |
2otQBYpmxrl |
| Name |
Vanillin |
| CAS Registry Number |
148-53-8 |
| 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 |
152.047344115 u |
| Formula |
C8H8O3 |
| InChI |
InChI=1S/C8H8O3/c1-11-7-4-2-3-6(5-9)8(7)10/h2-5,10H,1H3 |
| InChIKey |
JJVNINGBHGBWJH-UHFFFAOYSA-N |
| Molecular Weight |
152.149 g/mol |
| Number of Peaks |
50 |
| RI1 |
1305 |
| SMILES |
Oc1c(C=O)cccc1OC |
| SPLASH |
splash10-0udi-6900000000-4a6bf9c875dbee704708 |
| 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, 2-hydroxy-3-methoxy- |
| Wiley ID |
LM_FFNSC3_2253 |
