| SpectraBase Spectrum ID |
Hu9E4IcGZF7 |
| Name |
mandelate of [methyl 12-phenyl(2-deuterio)dodecanoate] |
| CAS Registry Number |
127251-35-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H35DO4 |
| InChI |
InChI=1S/C27H36O4/c1-30-27(29)26(24-20-14-10-15-21-24)31-25(28)22-16-8-6-4-2-3-5-7-11-17-23-18-12-9-13-19-23/h9-10,12-15,18-21,26H,2-8,11,16-17,22H2,1H3/i22D |
| InChIKey |
XCRGGDJYTPVUCD-JDANMYFYSA-N |
| Molecular Weight |
425.587 g/mol |
| SMILES |
C(C(=O)OC)(OC(=O)C(CCCCCCCCCCc1ccccc1)[2D])c1ccccc1 |
| SPLASH |
splash10-052f-9620000000-617e71943dba230a1c6b |
| Source of Spectrum |
H-72-927-0 |
| Wiley ID |
1379426 |
![mandelate of [methyl 12-phenyl(2-deuterio)dodecanoate]](/api/spectrum/Hu9E4IcGZF7/structure.png?h=300&w=458 "mandelate of [methyl 12-phenyl(2-deuterio)dodecanoate]")
