SpectraBase Spectrum ID |
LjB3a29Pyaw |
Name |
2,4-di-Tert-amylphenol, o-isopropyloxycarbonyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
320.235144887 u |
Formula |
C20H32O3 |
InChI |
InChI=1S/C20H32O3/c1-9-19(5,6)15-11-12-17(23-18(21)22-14(3)4)16(13-15)20(7,8)10-2/h11-14H,9-10H2,1-8H3 |
InChIKey |
PSPHXRIHNDRHFS-UHFFFAOYSA-N |
Molecular Weight |
320.473 g/mol |
SMILES |
C(CC)(C)(C)C1=CC(C(CC)(C)C)=CC=C1OC(OC(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.803483 |