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MBDB-D5 AC
SpectraBase Compound ID 5OTeiO1yohG
InChI InChI=1S/C14H19NO3/c1-4-12(15(3)10(2)16)7-11-5-6-13-14(8-11)18-9-17-13/h5-6,8,12H,4,7,9H2,1-3H3/i3D3,7D,12D
InChIKey WMMTZUXHOFMQKM-OBHJUQFCSA-N
Mol Weight 254.34 g/mol
Molecular Formula C14H14D5NO3
Exact Mass 254.167877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42pa0gd00O
Name MBDB-D5 AC
Classification Psychedelic Designer drug
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Exact Mass 254.167877202 u
Formula C14H14D5NO3
InChI InChI=1S/C14H19NO3/c1-4-12(15(3)10(2)16)7-11-5-6-13-14(8-11)18-9-17-13/h5-6,8,12H,4,7,9H2,1-3H3/i3D3,7D,12D
InChIKey WMMTZUXHOFMQKM-OBHJUQFCSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 254.341 g/mol
SMILES c1cc(cc2c1OCO2)C(C(CC)(N(C([D])([D])[D])C(=O)C)[D])[D]
SPLASH splash10-004i-7900000000-1ce72f03113996342a33
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_8764