| SpectraBase Spectrum ID |
3pxmOyD0YGf |
| Name |
Phenol, 2,6-dimethyl-, phosphite (3:1) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
394.169781724 u |
| Formula |
C24H27O3P |
| InChI |
InChI=1S/C24H27O3P/c1-16-10-7-11-17(2)22(16)25-28(26-23-18(3)12-8-13-19(23)4)27-24-20(5)14-9-15-21(24)6/h7-15H,1-6H3 |
| InChIKey |
YJLVKRVGSARISS-UHFFFAOYSA-N |
| Molecular Weight |
394.451 g/mol |
| SMILES |
C1=C(C)C(OP(OC=2C(C)=CC=CC2C)OC2=C(C)C=CC=C2C)=C(C=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.884797 |
