| SpectraBase Spectrum ID |
Jz7wg3OKXqz |
| Name |
(2-Methyl-1-oxaspiro[2.5]oct-2-yl)methyl benzoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
260.141244501 u |
| Formula |
C16H20O3 |
| InChI |
InChI=1S/C16H20O3/c1-15(16(19-15)10-6-3-7-11-16)12-18-14(17)13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-12H2,1H3 |
| InChIKey |
IEMSQVVFEUTASW-UHFFFAOYSA-N |
| Molecular Weight |
260.333 g/mol |
| SMILES |
C(C=1C=CC=CC1)(=O)OCC1(OC11CCCCC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915307 |
![(2-Methyl-1-oxaspiro[2.5]oct-2-yl)methyl benzoate](/api/spectrum/Jz7wg3OKXqz/structure.png?h=300&w=458 "(2-Methyl-1-oxaspiro[2.5]oct-2-yl)methyl benzoate")
