| SpectraBase Spectrum ID |
9ifNgZShSMT |
| Name |
5-Acetoxy-2-pentadecyl-1,3-dioxane |
| CAS Registry Number |
30889-26-0 |
| Classification |
Chemical |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
356.292659764 u |
| Formula |
C21H40O4 |
| InChI |
InChI=1S/C21H40O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-23-17-20(18-24-21)25-19(2)22/h20-21H,3-18H2,1-2H3 |
| InChIKey |
BLAASFFKTZQKDN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
356.547 g/mol |
| Nominal Mass |
356 u |
| Quality |
994 |
| Retention Index |
2538 |
| SMILES |
C1(COC(OC1)CCCCCCCCCCCCCCC)OC(=O)C |
| SPLASH |
splash10-0005-8900000000-d6bce6037aa6ea0b21fc |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_032816 |
