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2,6,9,9-Trimethyltricyclo[6.3.0.0(4,8)]undecan-1-one
SpectraBase Compound ID DGOvzv59mTr
InChI InChI=1S/C15H24O/c1-9-5-6-11-10(2)13(16)12-7-14(3,4)8-15(9,11)12/h9-12H,5-8H2,1-4H3/t9-,10?,11-,12-,15-/m0/s1
InChIKey CYJRANOSVJQJRA-IFPDENJQSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KoUcY0LgQVm
Name 2,6,9,9-Trimethyltricyclo[6.3.0.0(4,8)]undecan-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.182715392 u
Formula C15H24O
InChI InChI=1S/C15H24O/c1-9-5-6-11-10(2)13(16)12-7-14(3,4)8-15(9,11)12/h9-12H,5-8H2,1-4H3/t9-,10?,11-,12-,15-/m0/s1
InChIKey CYJRANOSVJQJRA-IFPDENJQSA-N
Molecular Weight 220.356 g/mol
SMILES [C@@]123[C@](C(=O)C([C@@]3(CC[C@@]1(C)[H])[H])C)(CC(C2)(C)C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.910514