| SpectraBase Compound ID | LL5vsGrYZG5 |
|---|---|
| InChI | InChI=1S/C26H45NO4/c1-5-6-7-8-9-10-11-12-13-14-17-21-18-15-16-19-22(21)24(29)23(20-28)27-25(30)31-26(2,3)4/h15-16,18-19,23-24,28-29H,5-14,17,20H2,1-4H3,(H,27,30)/t23-,24+/m0/s1 |
| InChIKey | KDDXTJBZUNEJEC-BJKOFHAPSA-N |
| Mol Weight | 435.6 g/mol |
| Molecular Formula | C26H45NO4 |
| Exact Mass | 435.334859 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8QzAqKUOTmZ |
|---|---|
| Name | (2S,3R)-2-(tert-Butoxycarbonylamino)-3-(dodecylphenyl)propane-1,3-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H45NO4 |
| InChI | InChI=1S/C26H45NO4/c1-5-6-7-8-9-10-11-12-13-14-17-21-18-15-16-19-22(21)24(29)23(20-28)27-25(30)31-26(2,3)4/h15-16,18-19,23-24,28-29H,5-14,17,20H2,1-4H3,(H,27,30)/t23-,24+/m0/s1 |
| InChIKey | KDDXTJBZUNEJEC-BJKOFHAPSA-N |
| Molecular Weight | 435.649 g/mol |
| SMILES | N(C(OC(C)(C)C)=O)[C@@](CO)([C@@](c1c(CCCCCCCCCCCC)cccc1)(O)[H])[H] |
| SPLASH | splash10-056r-6090000000-5629163a87bc03ebb420 |
| Source of Spectrum | F4-41-764-6 |
| Wiley ID | 1672079 |