| SpectraBase Spectrum ID |
Hm8lGQzzEbC |
| Name |
exo-4-T-Butyltricyclo[5.2.1.0(2,6)]dec-4-en-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
204.151415263 u |
| Formula |
C14H20O |
| InChI |
InChI=1S/C14H20O/c1-14(2,3)11-7-10-8-4-5-9(6-8)12(10)13(11)15/h7-10,12H,4-6H2,1-3H3 |
| InChIKey |
KGEBVHMATDOBBO-UHFFFAOYSA-N |
| Molecular Weight |
204.313 g/mol |
| SMILES |
C=1(C(C2C3CCC(C2C1)C3)=O)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947589 |