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Methadone-d9
SpectraBase Compound ID Givb0kNCptz
InChI InChI=1S/C21H27NO/c1-5-20(23)21(16-17(2)22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17H,5,16H2,1-4H3/i1D3,3D3,4D3
InChIKey USSIQXCVUWKGNF-MXOMHCEVSA-N
Mol Weight 318.51 g/mol
Molecular Formula C21H18D9NO
Exact Mass 318.265755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4px6qrAp2u
Name Methadone-D9
Classification Internal standard Potent analgesic
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Exact Mass 318.265755205 u
Formula C21H18D9NO
InChI InChI=1S/C21H27NO/c1-5-20(23)21(16-17(2)22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17H,5,16H2,1-4H3/i1D3,3D3,4D3
InChIKey USSIQXCVUWKGNF-MXOMHCEVSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 318.508 g/mol
SMILES c1c(cccc1)C(CC(N(C([D])([D])[D])C([D])([D])[D])C)(C(=O)CC([D])([D])[D])c1ccccc1
SPLASH splash10-004i-9300000000-ce3de22da3de610c0950
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_7820