| SpectraBase Spectrum ID |
4qgrGYK3LZQ |
| Name |
(3aR,7aR)-2,2-dideuterio-3a,4,5,6,7,7a-hexahydro-3H-indole-1-carboxylic acid methyl ester |
| CAS Registry Number |
117505-41-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H15D2NO2 |
| InChI |
InChI=1S/C10H17NO2/c1-13-10(12)11-7-6-8-4-2-3-5-9(8)11/h8-9H,2-7H2,1H3/t8-,9-/m1/s1/i7D2 |
| InChIKey |
VVULVCJPIMQQBY-OIYIUPPQSA-N |
| Molecular Weight |
185.263 g/mol |
| SMILES |
C(N1[C@]2([C@@](CCCC2)([H])CC1([2D])[2D])[H])(=O)OC |
| SPLASH |
splash10-0006-0900000000-876e8f059896690caaa3 |
| Source of Spectrum |
Y-25-70-6 |
| Synonyms |
methyl (3aR,7aR)-2,2-dideuterio-3a,4,5,6,7,7a-hexahydro-3H-indole-1-carboxylate |
| Wiley ID |
1179771 |
