SpectraBase Spectrum ID |
CbrhCPqnUMO |
Name |
[4,4,5,5-tetradeuterate]-6-hydroxytridecan-2-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H22D4O2 |
InChI |
InChI=1S/C13H26O2/c1-3-4-5-6-7-10-13(15)11-8-9-12(2)14/h13,15H,3-11H2,1-2H3/i8D2,11D2 |
InChIKey |
OPYSJEMBBDQGQP-ZUPNMEAQSA-N |
Literature Reference DOI |
10.1002/cbic.201000481 |
Molecular Weight |
218.373 g/mol |
SMILES |
OC(C(C(CC(=O)C)([D])[D])([D])[D])CCCCCCC |
SPLASH |
splash10-052f-9000000000-05dfa55e07cfca6abed6 |
Source of Spectrum |
CBC-12-170-[D4]_30 |
Synonyms |
6-Hydroxytridecan-2-one-4,4,5,5-d4 |
Wiley ID |
1786707 |