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N-Methyl-U-47931E
SpectraBase Compound ID Jenq9UAciGb
InChI InChI=1S/C17H24BrNO/c1-12(15-6-4-5-7-16(15)19(2)3)17(20)13-8-10-14(18)11-9-13/h8-12,15-16H,4-7H2,1-3H3
InChIKey QTAMUFCGAIUYDR-UHFFFAOYSA-N
Mol Weight 338.29 g/mol
Molecular Formula C17H24BrNO
Exact Mass 337.104127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AziYbTDVFU8
Name N-Methyl-U-47931E
Classification Designer opioid
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Exact Mass 337.104127396 u
Formula C16H23N2OBr
InChI InChI=1S/C17H24BrNO/c1-12(15-6-4-5-7-16(15)19(2)3)17(20)13-8-10-14(18)11-9-13/h8-12,15-16H,4-7H2,1-3H3
InChIKey QTAMUFCGAIUYDR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 338.289 g/mol
SMILES c1cc(C(=O)C(C)C2C(CCCC2)N(C)C)ccc1Br
SPLASH splash10-0560-7900000000-1cf536d2dbaae5661c99
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_10607