SpectraBase Spectrum ID |
5oCY0UpPyGX |
Name |
6T,10T-Dimethyl-(5RC1)spiro[4.5]decan-2-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
180.151415263 u |
Formula |
C12H20O |
InChI |
InChI=1S/C12H20O/c1-9-4-3-5-10(2)12(9)7-6-11(13)8-12/h9-10H,3-8H2,1-2H3/t9-,10+,12+ |
InChIKey |
MFAMPWFLDSCABJ-IAZYJMLFSA-N |
Molecular Weight |
180.291 g/mol |
SMILES |
[C@]12(CCC(C2)=O)[C@@](CCC[C@@]1(C)[H])(C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.823474 |