| SpectraBase Spectrum ID |
JFK0BLw4SOW |
| Name |
4-Hydroxy-benzenepropanoic acid octadecyl ester |
| CAS Registry Number |
42933-23-3 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
418.344695338 u |
| Formula |
C27H46O3 |
| InChI |
InChI=1S/C27H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-30-27(29)23-20-25-18-21-26(28)22-19-25/h18-19,21-22,28H,2-17,20,23-24H2,1H3 |
| InChIKey |
OBYWBISWWBUSET-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
418.662 g/mol |
| Nominal Mass |
418 u |
| Quality |
687 |
| Retention Index |
3001 |
| SMILES |
OC1=CC=C(C=C1)CCC(OCCCCCCCCCCCCCCCCCC)=O |
| SPLASH |
splash10-06di-3900100000-a25f8c47b19e334ae43e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
octadecyl 3-(4-hydroxyphenyl)propanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004524 |
