| SpectraBase Compound ID | BjVEPmHN7PM |
|---|---|
| InChI | InChI=1S/C13H15Cl/c14-13-7-6-10(9-13)8-12(13)11-4-2-1-3-5-11/h1-5,10,12H,6-9H2/t10-,12?,13+/m0/s1/i1D,2D,3D,4D,5D,9D/t9-,10-,12?,13+ |
| InChIKey | DATFUJWDPQHCCV-AHGGVDNFSA-N |
| Mol Weight | 212.75 g/mol |
| Molecular Formula | C13H92D6Cl |
| Exact Mass | 212.123889 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7HsFawvog0m |
|---|---|
| Name | 1-Chloro-7-deuterio-2-phenyl-(pentadeuterio)-nor-bornane |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H9D6Cl |
| InChI | InChI=1S/C13H15Cl/c14-13-7-6-10(9-13)8-12(13)11-4-2-1-3-5-11/h1-5,10,12H,6-9H2/t10-,12?,13+/m0/s1/i1D,2D,3D,4D,5D,9D/t9-,10-,12?,13+ |
| InChIKey | DATFUJWDPQHCCV-AHGGVDNFSA-N |
| Molecular Weight | 212.753 g/mol |
| SMILES | [C@@]12(C(C[C@@]([C@@]2([2D])[H])(CC1)[H])c1c(c([2D])c(c(c1[2D])[2D])[2D])[2D])Cl |
| SPLASH | splash10-03fr-0590000000-1a4905a6ba835f1bf90b |
| Source of Spectrum | C-126-12531-1a-d6 |
| Wiley ID | 1714582 |