SpectraBase Spectrum ID |
FJKKEQkpBIT |
Name |
Nonanoic acid, 5-acetyl-3,4,4-trimethyl-8-oxo-, methyl ester, [S-(R*,R*)]- |
CAS Registry Number |
124708-27-6 |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H26O4 |
InChI |
InChI=1S/C15H26O4/c1-10(9-14(18)19-6)15(4,5)13(12(3)17)8-7-11(2)16/h10,13H,7-9H2,1-6H3/t10-,13+/m0/s1 |
InChIKey |
RQLGVUXAEGYGAW-GXFFZTMASA-N |
Molecular Weight |
270.369 g/mol |
SMILES |
C([C@](CCC(=O)C)(C(=O)C)[H])([C@](CC(=O)OC)(C)[H])(C)C |
SPLASH |
splash10-0006-9200000000-b07f16cb635964c0ace3 |
Source of Spectrum |
H-72-294-12 |
Synonyms |
Methyl (3S,5S)-5-acetyl-3,4,4-trimethyl-8-oxononancarboxylate
Methyl (3S,5S)-5-acetyl-3,4,4-trimethyl-8-oxononanoate |
Wiley ID |
1274218 |