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2,6-bis[(Dimethylamino)methyl]cyclohexanone, dihydrochloride
SpectraBase Compound ID 9NPF79ibtfN
InChI InChI=1S/C12H24N2O.2ClH/c1-13(2)8-10-6-5-7-11(12(10)15)9-14(3)4;;/h10-11H,5-9H2,1-4H3;2*1H
InChIKey BAQVTPCSZOZZTI-UHFFFAOYSA-N
Mol Weight 285.26 g/mol
Molecular Formula C12H26Cl2N2O
Exact Mass 284.142219 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID G6OIWRFvM56
Name 2,6-bis[(Dimethylamino)methyl]cyclohexanone, dihydrochloride
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 284.142218864 u
Formula C12H26Cl2N2O
InChI InChI=1S/C12H24N2O.2ClH/c1-13(2)8-10-6-5-7-11(12(10)15)9-14(3)4;;/h10-11H,5-9H2,1-4H3;2*1H
InChIKey BAQVTPCSZOZZTI-UHFFFAOYSA-N
Molecular Weight 285.259 g/mol
SMILES C1C(C(C(CC1)CN(C)C)=O)CN(C)C.Cl.Cl
Spectrum/Structure Validation Score (Raman) 0.804221