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5MT-NB2OMe TFA
SpectraBase Compound ID 1ON7sb9PpWh
InChI InChI=1S/C21H21F3N2O3/c1-28-16-7-8-18-17(11-16)14(12-25-18)9-10-26(20(27)21(22,23)24)13-15-5-3-4-6-19(15)29-2/h3-8,11-12,25H,9-10,13H2,1-2H3
InChIKey CXPZIAUYLPAOAR-UHFFFAOYSA-N
Mol Weight 406.41 g/mol
Molecular Formula C21H21F3N2O3
Exact Mass 406.150427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4t36Eur9MF3
Name 5MT-NB2OMe TFA
Classification Designer drug
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Exact Mass 406.150427030 u
Formula C21H21N2O3F3
InChI InChI=1S/C21H21F3N2O3/c1-28-16-7-8-18-17(11-16)14(12-25-18)9-10-26(20(27)21(22,23)24)13-15-5-3-4-6-19(15)29-2/h3-8,11-12,25H,9-10,13H2,1-2H3
InChIKey CXPZIAUYLPAOAR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 406.405 g/mol
SMILES c1(cc2c(CCN(C(=O)C(F)(F)F)Cc3ccccc3OC)c[nH]c2cc1)OC
SPLASH splash10-03di-1900000000-310758778319b6b55405
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_9931