| SpectraBase Compound ID | 2Sb9EE7VFpA |
|---|---|
| InChI | InChI=1S/C13H17ClO/c1-2-6-12(14)13(15)10-9-11-7-4-3-5-8-11/h3-5,7-8,12H,2,6,9-10H2,1H3/i12D |
| InChIKey | AGLNUQYWMRHXBG-UQBWLURTSA-N |
| Mol Weight | 225.74 g/mol |
| Molecular Formula | C13H162DClO |
| Exact Mass | 225.10307 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 | BGxe3L4kHiu |
|---|---|
| Name | 4-Chloro-4-deuterio-1-phenyl-3-heptanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H16DClO |
| InChI | InChI=1S/C13H17ClO/c1-2-6-12(14)13(15)10-9-11-7-4-3-5-8-11/h3-5,7-8,12H,2,6,9-10H2,1H3/i12D |
| InChIKey | AGLNUQYWMRHXBG-UQBWLURTSA-N |
| Molecular Weight | 225.737 g/mol |
| SMILES | C(CC(C(CCC)([2D])Cl)=O)c1ccccc1 |
| SPLASH | splash10-0a59-0900000000-dc46a86f15aa703962f3 |
| Source of Spectrum | AJ-65-2804-13 |
| Wiley ID | 771589 |