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25B-NBOMe-M (demethyl-) iso-1 2AC
SpectraBase Compound ID 25dH1MhSmYz
InChI InChI=1S/C21H24BrNO5/c1-14(24)23(13-17-7-5-6-8-19(17)26-3)10-9-16-11-21(27-4)18(22)12-20(16)28-15(2)25/h5-8,11-12H,9-10,13H2,1-4H3
InChIKey NTLOJTVEZZYIMH-UHFFFAOYSA-N
Mol Weight 450.33 g/mol
Molecular Formula C21H24BrNO5
Exact Mass 449.083786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID zK26msIF6
Name 25B-NBOMe-M (demethyl-) iso-2 2AC
Classification Designer drug
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Exact Mass 449.083785872 u
Formula C21H24NO5Br
InChI InChI=1S/C21H24BrNO5/c1-14(24)23(13-17-7-5-6-8-19(17)26-3)10-9-16-11-21(27-4)18(22)12-20(16)28-15(2)25/h5-8,11-12H,9-10,13H2,1-4H3
InChIKey NTLOJTVEZZYIMH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 450.329 g/mol
SMILES c1(c(cc(c(c1)OC)Br)OC(=O)C)CCN(Cc1c(cccc1)OC)C(=O)C
SPLASH splash10-00dl-4930000000-0d5fbd2d001188e68a74
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
Synonyms 25B-NBOMe-M (O-demethyl-) isomer-2 2AC
Technique GC/MS
Wiley ID MMPW6e_9387