| SpectraBase Spectrum ID |
Epyxn7JVSK7 |
| Name |
Piperonal |
| CAS Registry Number |
120-57-0 |
| 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 |
150.031694050 u |
| Formula |
C8H6O3 |
| InChI |
InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2 |
| InChIKey |
SATCULPHIDQDRE-UHFFFAOYSA-N |
| Molecular Weight |
150.133 g/mol |
| Number of Peaks |
47 |
| RI1 |
1333 |
| RI2 |
1010 |
| SMILES |
c1(ccc2c(c1)OCO2)C=O |
| SPLASH |
splash10-0ika-7900000000-b648a134de50f0db27a4 |
| 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 |
1,3-Benzodioxole-5-carboxaldehyde |
| Wiley ID |
LM_FFNSC3_987 |
