SpectraBase Spectrum ID |
KJNgYyIAkjy |
Name |
4'-Hydroxy-3'-methoxyacetophenone, isopropyl ether |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
208.109944372 u |
Formula |
C12H16O3 |
InChI |
InChI=1S/C12H16O3/c1-8(2)15-11-6-5-10(9(3)13)7-12(11)14-4/h5-8H,1-4H3 |
InChIKey |
PAXBEXJJMTYDKY-UHFFFAOYSA-N |
Molecular Weight |
208.257 g/mol |
SMILES |
C1(=CC(OC)=C(C=C1)OC(C)C)C(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973066 |