| SpectraBase Spectrum ID |
8C8Tgd6hSN0 |
| Name |
Panthenol 3AC |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
331.163102142 u |
| Formula |
C15H25NO7 |
| InChI |
InChI=1S/C15H25NO7/c1-10(17)16(7-6-8-22-11(2)18)14(21)13(20)15(4,5)9-23-12(3)19/h13,20H,6-9H2,1-5H3/t13-/m0/s1 |
| InChIKey |
CCHPZLLTMFBBHJ-ZDUSSCGKSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
331.365 g/mol |
| Nominal Mass |
331 u |
| Quality |
922 |
| Retention Index |
2408 |
| SMILES |
O[C@](C(COC(=O)C)(C)C)(C(N(C(=O)C)CCCOC(=O)C)=O)[H] |
| SPLASH |
splash10-014i-3920000000-7d6504555a6d92ccd251 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-(acetyl((2R)-4-(acetyloxy)-2-hydroxy-3,3-dimethylbutanoyl)amino)propyl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_003473 |
