| SpectraBase Spectrum ID |
7s5dUmeKJ5B |
| Name |
1,1-Dimethoxy-4-methyl-6-phenoxyhexane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
252.172544630 u |
| Formula |
C15H24O3 |
| InChI |
InChI=1S/C15H24O3/c1-13(9-10-15(16-2)17-3)11-12-18-14-7-5-4-6-8-14/h4-8,13,15H,9-12H2,1-3H3 |
| InChIKey |
QKSPEBDCIOPQTA-UHFFFAOYSA-N |
| Molecular Weight |
252.354 g/mol |
| SMILES |
C(CCC(CCOC=1C=CC=CC1)C)(OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.802233 |
