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Acetamide, N,N'-[1,4-cyclohexanediyl-1,4-D2-bis(methylene)]bis-, trans-
SpectraBase Compound ID 4wGdxrwdY2P
InChI InChI=1S/C12H22N2O2/c1-9(15)13-7-11-3-5-12(6-4-11)8-14-10(2)16/h11-12H,3-8H2,1-2H3,(H,13,15)(H,14,16)/t11-,12-/i11D,12D
InChIKey GUHHUMFYAACNTR-XPDNTXFPSA-N
Mol Weight 228.33 g/mol
Molecular Formula C12H202D2N2O2
Exact Mass 228.180681 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GhzDNUyqOH
Name Acetamide, N,N'-[1,4-cyclohexanediyl-1,4-D2-bis(methylene)]bis-, trans-
Alternate Name(s) trans-1,4-bis(acetamidomethyl)-1,4-dideuteriocyclohexane
CAS Registry Number 70925-29-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20D2N2O2
InChI InChI=1S/C12H22N2O2/c1-9(15)13-7-11-3-5-12(6-4-11)8-14-10(2)16/h11-12H,3-8H2,1-2H3,(H,13,15)(H,14,16)/t11-,12-/i11D,12D
InChIKey GUHHUMFYAACNTR-XPDNTXFPSA-N
Molecular Weight 228.332 g/mol
SMILES N(C(=O)C)C[C@]1(CC[C@](CNC(=O)C)(CC1)[2D])[2D]
SPLASH splash10-05ai-9300000000-4061980112fdbfd96d9a
Source of Spectrum H-62-1062-0
Wiley ID 1227424