| SpectraBase Compound ID | IjTJynk25zp |
|---|---|
| InChI | InChI=1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2,4-6H,1,3,7H2 |
| InChIKey | ZMQAAUBTXCXRIC-UHFFFAOYSA-N |
| Mol Weight | 162.19 g/mol |
| Molecular Formula | C10H10O2 |
| Exact Mass | 162.06808 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | K23e2xF8zQ7 |
|---|---|
| Name | Safrol |
| Comments | MONAID: JP009448 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H10O2 |
| InChI | InChI=1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2,4-6H,1,3,7H2 |
| InChIKey | ZMQAAUBTXCXRIC-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 162.188 g/mol |
| SMILES | C=CCc1ccc2c(c1)OCO2 |
| SPLASH | splash10-0ik9-5900000000-d9da279b2ae640279635 |
| Source of Spectrum | SRH-2022-9448-0 |
| Wiley ID | 1831109 |