SpectraBase Spectrum ID |
5eoSdOzYo8t |
Name |
2'-Hydroxy-4'-methoxyacetophenone, pentyl ether |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
236.141244501 u |
Formula |
C14H20O3 |
InChI |
InChI=1S/C14H20O3/c1-4-5-6-9-17-14-10-12(16-3)7-8-13(14)11(2)15/h7-8,10H,4-6,9H2,1-3H3 |
InChIKey |
IXSYCDSPEJWRNY-UHFFFAOYSA-N |
Molecular Weight |
236.311 g/mol |
SMILES |
C1(=C(C=C(C=C1)OC)OCCCCC)C(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.980839 |