| SpectraBase Spectrum ID |
JJ0ekqpd87s |
| Name |
Asarone |
| CAS Registry Number |
2883-98-9 |
| Classification |
Flavor |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
208.109944372 u |
| Formula |
C12H16O3 |
| InChI |
InChI=1S/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5-8H,1-4H3/b6-5+ |
| InChIKey |
RKFAZBXYICVSKP-AATRIKPKSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
208.257 g/mol |
| Nominal Mass |
208 u |
| Quality |
998 |
| Retention Index |
1500 |
| SMILES |
C1(=C(C=C(C(=C1)OC)OC)\C=C\C)OC |
| SPLASH |
splash10-0a4l-4920000000-521ebc66b89e2f0f097c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Benzene,1,2,4-trimethoxy-5-(1-propenyl)-
1,2,4-Trimethoxy-5-[(E)-prop-1-enyl]benzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_019159 |
