| SpectraBase Compound ID | 3EmAmOa5fAT |
|---|---|
| InChI | InChI=1S/C14H18O2/c1-2-3-9-13(15)10-11-14(16)12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3 |
| InChIKey | QSLOKTFKZKWVEL-UHFFFAOYSA-N |
| Mol Weight | 218.3 g/mol |
| Molecular Formula | C14H18O2 |
| Exact Mass | 218.13068 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9ICgizmlqgz |
|---|---|
| Name | 1-phenyloctane-1,4-dione |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H18O2 |
| InChI | InChI=1S/C14H18O2/c1-2-3-9-13(15)10-11-14(16)12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3 |
| InChIKey | QSLOKTFKZKWVEL-UHFFFAOYSA-N |
| Molecular Weight | 218.296 g/mol |
| SMILES | C(=O)(CCC(=O)CCCC)c1ccccc1 |
| SPLASH | splash10-0a4i-0900000000-21b02278dc268e34974c |
| Source of Spectrum | J-59-4183-5 |
| Wiley ID | 1218053 |