| SpectraBase Spectrum ID |
BQg0OfLGB3O |
| Name |
Piperonal, diethyl acetal |
| CAS Registry Number |
40527-42-2 |
| 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 |
224.104858991 u |
| Formula |
C12H16O4 |
| InChI |
InChI=1S/C12H16O4/c1-3-13-12(14-4-2)9-5-6-10-11(7-9)16-8-15-10/h5-7,12H,3-4,8H2,1-2H3 |
| InChIKey |
YDQLGNDCYHZHEE-UHFFFAOYSA-N |
| Molecular Weight |
224.256 g/mol |
| Number of Peaks |
50 |
| RI1 |
1573 |
| RI2 |
1251 |
| RI3 |
1953 |
| RI4 |
1915 |
| RI5 |
1546 |
| SMILES |
C(C)OC(c1cc2c(OCO2)cc1)OCC |
| SPLASH |
splash10-0fb9-3900000000-3ffeef4b9cd1f028893b |
| 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-(diethoxymethyl) |
| Wiley ID |
LM_FFNSC3_3317 |
