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5MT-NB3OMe AC
SpectraBase Compound ID 2Td7e3cd5yY
InChI InChI=1S/C21H24N2O3/c1-15(24)23(14-16-5-4-6-18(11-16)25-2)10-9-17-13-22-21-8-7-19(26-3)12-20(17)21/h4-8,11-13,22H,9-10,14H2,1-3H3
InChIKey XBCARBIGPNDSSS-UHFFFAOYSA-N
Mol Weight 352.43 g/mol
Molecular Formula C21H24N2O3
Exact Mass 352.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EILXy6WVrlK
Name 5MT-NB3OMe AC
Classification Designer drug
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Exact Mass 352.178692638 u
Formula C21H24N2O3
InChI InChI=1S/C21H24N2O3/c1-15(24)23(14-16-5-4-6-18(11-16)25-2)10-9-17-13-22-21-8-7-19(26-3)12-20(17)21/h4-8,11-13,22H,9-10,14H2,1-3H3
InChIKey XBCARBIGPNDSSS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 352.434 g/mol
SMILES c1(ccc2[nH]cc(c2c1)CCN(Cc1cc(ccc1)OC)C(=O)C)OC
SPLASH splash10-00di-1900000000-685e0f41168cb64c55cc
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_9938