| SpectraBase Spectrum ID |
93dLWCCgusd |
| Name |
(2S*,3S*)-3-diphenylphosphinoyl-2-acetoxyheptanoaic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25O5P |
| InChI |
InChI=1S/C21H25O5P/c1-3-4-15-19(20(21(23)24)26-16(2)22)27(25,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,19-20H,3-4,15H2,1-2H3,(H,23,24)/t19-,20+/m0/s1 |
| InChIKey |
IVFXZZRINURADE-VQTJNVASSA-N |
| Molecular Weight |
388.400 g/mol |
| SMILES |
OC([C@@]([C@@](P(=O)(c1ccccc1)c1ccccc1)(CCCC)[H])(OC(=O)C)[H])=O |
| SPLASH |
splash10-0udi-0090000000-a0112513c9afe10f3f5e |
| Source of Spectrum |
KC-0-1993-31 |
| Wiley ID |
828701 |
