| SpectraBase Spectrum ID |
JF3HcOGd9Ky |
| Name |
Safranal |
| CAS Registry Number |
581-49-7 |
| Classification |
Pharmaceutical drug, anticonvulsant |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
150.104465070 u |
| Formula |
C10H14O |
| InChI |
InChI=1S/C10H14O/c1-8-5-4-6-10(2,3)9(8)7-11/h4-5,7H,6H2,1-3H3 |
| InChIKey |
SGAWOGXMMPSZPB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
150.221 g/mol |
| Nominal Mass |
150 u |
| Quality |
904 |
| Retention Index |
1188 |
| SMILES |
C=1(C(CC=CC1C)(C)C)C=O |
| SPLASH |
splash10-0a6u-9700000000-3afcda38fbbb1cfc80b3 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl- |
| Technique |
GC/MS |
| Wiley ID |
DD2024_020966 |
