| SpectraBase Spectrum ID |
HcpTV1Ykr0X |
| Name |
(1S,4S)-1-acetoxy-2,2,3,3,4-pentadeuterio-4-methylcyclohexane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H11D5O2 |
| InChI |
InChI=1S/C9H16O2/c1-7-3-5-9(6-4-7)11-8(2)10/h7,9H,3-6H2,1-2H3/t7-,9-/i3D2,5D2,7D/m1/s1 |
| InChIKey |
VJBFCCCTSQEGMH-QUQNRABASA-N |
| Molecular Weight |
161.256 g/mol |
| SMILES |
C(O[C@]1(CC[C@@](C(C1([D])[D])([D])[D])(C)[D])[H])(=O)C |
| SPLASH |
splash10-0006-9300000000-933f27edae65a87abc8f |
| Source of Spectrum |
J-45-2683-0 |
| Wiley ID |
1153932 |
