| SpectraBase Spectrum ID |
1it3SnLogBs |
| Name |
Butanal-2-d, 3-hydroxy-3-methyl-, (S)- |
| CAS Registry Number |
117138-07-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C5H9DO2 |
| InChI |
InChI=1S/C5H10O2/c1-5(2,7)3-4-6/h4,7H,3H2,1-2H3/i3D/t3-/m1/s1 |
| InChIKey |
FXFBPKDQLDOIRG-QSLQMRRESA-N |
| Molecular Weight |
103.139 g/mol |
| SMILES |
OC([C@@](C=O)([D])[H])(C)C |
| SPLASH |
splash10-052f-9000000000-f320658992ae1c59580f |
| Source of Spectrum |
KC-1987-2847-13 |
| Synonyms |
(S)-[2-(2)H]-3-hydroxy-3-methylbutanal |
| Wiley ID |
1120464 |
