| SpectraBase Spectrum ID |
5lax15qVyvB |
| Name |
(1S,4S)-1-acetyl-2,2,3,3,4-pentadeuterio-4-methylcyclohexane |
| CAS Registry Number |
73687-72-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H11D5O |
| InChI |
InChI=1S/C9H16O/c1-7-3-5-9(6-4-7)8(2)10/h7,9H,3-6H2,1-2H3/t7-,9-/i3D2,5D2,7D/m1/s1 |
| InChIKey |
HTAYNGUDHFAFFQ-QUQNRABASA-N |
| Molecular Weight |
145.257 g/mol |
| SMILES |
C([C@@]1(C(C([D])([D])[C@](CC1)(C)[D])([D])[D])[H])(=O)C |
| SPLASH |
splash10-0006-9200000000-b17aa7bf65c229060195 |
| Source of Spectrum |
J-45-2683-0 |
| Wiley ID |
1139869 |
