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5MT-NB3Me artifact
SpectraBase Compound ID 4ETsWyzXkSy
InChI InChI=1S/C20H22N2O/c1-15-3-5-16(6-4-15)12-21-10-9-17-13-22(14-21)20-8-7-18(23-2)11-19(17)20/h3-8,11,13H,9-10,12,14H2,1-2H3
InChIKey BMJIKOPYKFPJOD-UHFFFAOYSA-N
Mol Weight 306.41 g/mol
Molecular Formula C20H22N2O
Exact Mass 306.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FGO8LGLeLEU
Name 5MT-NB3Me artifact
Classification Designer drug
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Exact Mass 306.173213335 u
Formula C20H22N2O
InChI InChI=1S/C20H22N2O/c1-15-3-5-16(6-4-15)12-21-10-9-17-13-22(14-21)20-8-7-18(23-2)11-19(17)20/h3-8,11,13H,9-10,12,14H2,1-2H3
InChIKey BMJIKOPYKFPJOD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 306.409 g/mol
SMILES c1(OC)ccc2c(c1)c1CCN(C[n]2c1)Cc1ccc(cc1)C
SPLASH splash10-00di-0900000000-006617f37844203140bc
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_9956