| SpectraBase Spectrum ID |
HmELId2okh9 |
| Name |
Fumaric acid, dodecyl 2-norbornyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.277009700 u |
| Formula |
C23H38O4 |
| InChI |
InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-16-26-22(24)14-15-23(25)27-21-18-19-12-13-20(21)17-19/h14-15,19-21H,2-13,16-18H2,1H3/b15-14+/t19-,20+,21+/m1/s1 |
| InChIKey |
KURSALJNHBTWNA-MBTLSUMZSA-N |
| Molecular Weight |
378.553 g/mol |
| SMILES |
CCCCCCCCCCCCOC(\C=C\C(O[C@]1(C[C@@]2(CC[C@]1(C2)[H])[H])[H])=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.860674 |
