| SpectraBase Spectrum ID |
7nW4T9dzdQI |
| Name |
1,2,4-Benzenetriol, tris(2-methylpropionate) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.157288487 u |
| Formula |
C18H24O6 |
| InChI |
InChI=1S/C18H24O6/c1-10(2)16(19)22-13-7-8-14(23-17(20)11(3)4)15(9-13)24-18(21)12(5)6/h7-12H,1-6H3 |
| InChIKey |
CXIFKRAQNMMUMD-UHFFFAOYSA-N |
| Molecular Weight |
336.384 g/mol |
| SMILES |
C1(OC(C(C)C)=O)=C(OC(C(C)C)=O)C=CC(=C1)OC(C(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959984 |
