| SpectraBase Spectrum ID |
J06aNrAs9L5 |
| Name |
1,4-Dimethyltricyclo[5.3.0.0(4.10)]decan-8-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
178.135765199 u |
| Formula |
C12H18O |
| InChI |
InChI=1S/C12H18O/c1-11-4-3-8-9(13)7-10(11)12(8,2)6-5-11/h8,10H,3-7H2,1-2H3/t8-,10+,11+,12-/m1/s1 |
| InChIKey |
XKLVEBRFZOMFFO-NUGNTBJXSA-N |
| Molecular Weight |
178.275 g/mol |
| SMILES |
C1[C@@]2(C(C[C@@]3([C@@]2(CC[C@@]3(C1)C)C)[H])=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962783 |
![1,4-Dimethyltricyclo[5.3.0.0(4.10)]decan-8-one](/api/spectrum/J06aNrAs9L5/structure.png?h=300&w=458 "1,4-Dimethyltricyclo[5.3.0.0(4.10)]decan-8-one")
