| SpectraBase Spectrum ID |
L8kORmTNSLu |
| Name |
Succinic acid, docosyl isobutyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
482.433510344 u |
| Formula |
C30H58O4 |
| InChI |
InChI=1S/C30H58O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-33-29(31)24-25-30(32)34-27-28(2)3/h28H,4-27H2,1-3H3 |
| InChIKey |
BORZPTOBFYFUAF-UHFFFAOYSA-N |
| Molecular Weight |
482.790 g/mol |
| SMILES |
C(C(OCCCCCCCCCCCCCCCCCCCCCC)=O)CC(OCC(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942005 |
