SpectraBase Spectrum ID |
I4LvUZFF2Oy |
Name |
Bicyclo[3.2.2]non-3-en-2-one, 5-methyl-1-(1-methylethyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
192.151415263 u |
Formula |
C13H20O |
InChI |
InChI=1S/C13H20O/c1-10(2)13-8-6-12(3,7-9-13)5-4-11(13)14/h4-5,10H,6-9H2,1-3H3 |
InChIKey |
DKYJVTLXURVLBE-UHFFFAOYSA-N |
Molecular Weight |
192.302 g/mol |
SMILES |
C12(C(C=CC(CC2)(C)CC1)=O)C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.881124 |