SpectraBase Spectrum ID |
8CQH4a84CB9 |
Name |
7,9-di-Tertbutyl-1-oxaspiro[4,5]deca-6,9-dien-8-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
262.193280075 u |
Formula |
C17H26O2 |
InChI |
InChI=1S/C17H26O2/c1-15(2,3)12-10-17(8-7-9-19-17)11-13(14(12)18)16(4,5)6/h10-11H,7-9H2,1-6H3 |
InChIKey |
NXVCHTCAMYVBEC-UHFFFAOYSA-N |
Molecular Weight |
262.393 g/mol |
SMILES |
C1CCOC11C=C(C(C(=C1)C(C)(C)C)=O)C(C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965606 |