| SpectraBase Spectrum ID |
JwwwwBjBj86 |
| Name |
3-[5-(Tetrahydro-2-pyranyloxy)pentyl]-2-cyclohexen-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.188194694 u |
| Formula |
C16H26O3 |
| InChI |
InChI=1S/C16H26O3/c17-15-9-6-8-14(13-15)7-2-1-4-11-18-16-10-3-5-12-19-16/h13,16H,1-12H2 |
| InChIKey |
WBBCOTCAPWREGE-UHFFFAOYSA-N |
| Molecular Weight |
266.381 g/mol |
| SMILES |
C1=C(CCCC1=O)CCCCCOC1OCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953433 |