| SpectraBase Spectrum ID |
8GvSfn3ASAa |
| Name |
Apiol |
| CAS Registry Number |
523-80-8 |
| Classification |
Uterine stimulant, diuretic, antipyretic |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
222.089208927 u |
| Formula |
C12H14O4 |
| InChI |
InChI=1S/C12H14O4/c1-4-5-8-6-9(13-2)11-12(10(8)14-3)16-7-15-11/h4,6H,1,5,7H2,2-3H3 |
| InChIKey |
QQRSPHJOOXUALR-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
222.240 g/mol |
| Nominal Mass |
222 u |
| Quality |
992 |
| Retention Index |
1640 |
| SMILES |
C1=2C(=C(C(=CC2OC)CC=C)OC)OCO1 |
| SPLASH |
splash10-00di-8980000000-a99ab8f8038aa323d982 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Allyl-2,5-dimethoxy-3,4-methylenedioxybenzene
Parsley Camphor
Petersilien-Campher
5-Allyl-4,7-dimethoxy-1,3-benzodioxol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_014632 |
