| SpectraBase Spectrum ID |
CXX7Vh0woAc |
| Name |
(2S)-Methyl 2-[.alpha-phenylacetoacetoxy]hexadecanoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H42O6 |
| InChI |
InChI=1S/C27H42O6/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-24(26(29)31-3)33-27(30)25(32-22(2)28)23-19-16-15-17-20-23/h15-17,19-20,24-25H,4-14,18,21H2,1-3H3/t24-,25?/m0/s1 |
| InChIKey |
VZJXUEUZEIPCMY-SKCDSABHSA-N |
| Molecular Weight |
462.627 g/mol |
| SMILES |
C(C(OC(=O)C)c1ccccc1)(O[C@](C(=O)OC)(CCCCCCCCCCCCCC)[H])=O |
| SPLASH |
splash10-004i-0900000000-3556ce74d0895c1db2f4 |
| Source of Spectrum |
E1-41-1542-20 |
| Synonyms |
(2S)-Methyl 2-[..alpha.-phenylacetoacetoxy]hexadecanoate
methyl (2S)-2-{[(acetyloxy)(phenyl)acetyl]oxy}hexadecanoate |
| Wiley ID |
1559721 |
![(2S)-Methyl 2-[.alpha-phenylacetoacetoxy]hexadecanoate](/api/spectrum/CXX7Vh0woAc/structure.png?h=300&w=458 "(2S)-Methyl 2-[.alpha-phenylacetoacetoxy]hexadecanoate")
