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5MT-NB3Me AC
SpectraBase Compound ID EfKcGoOIFBY
InChI InChI=1S/C21H24N2O2/c1-15-5-4-6-17(11-15)14-23(16(2)24)10-9-18-13-22-21-8-7-19(25-3)12-20(18)21/h4-8,11-13,22H,9-10,14H2,1-3H3
InChIKey LWKOXQLFRBITSR-UHFFFAOYSA-N
Mol Weight 336.44 g/mol
Molecular Formula C21H24N2O2
Exact Mass 336.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JrNcmoZ8MMK
Name 5MT-NB3Me AC
Classification Designer drug
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Exact Mass 336.183778019 u
Formula C21H24N2O2
InChI InChI=1S/C21H24N2O2/c1-15-5-4-6-17(11-15)14-23(16(2)24)10-9-18-13-22-21-8-7-19(25-3)12-20(18)21/h4-8,11-13,22H,9-10,14H2,1-3H3
InChIKey LWKOXQLFRBITSR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 336.435 g/mol
SMILES c1(ccc2[nH]cc(c2c1)CCN(Cc1cc(ccc1)C)C(=O)C)OC
SPLASH splash10-00di-0900000000-e2a82d992bf005847af3
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_9957