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5MT-NB3I 2TMS
SpectraBase Compound ID GKGUtbXDAof
InChI InChI=1S/C24H35IN2OSi2/c1-28-22-11-12-24-23(16-22)20(18-27(24)30(5,6)7)13-14-26(29(2,3)4)17-19-9-8-10-21(25)15-19/h8-12,15-16,18H,13-14,17H2,1-7H3
InChIKey JRLAVPPCJXTUIN-UHFFFAOYSA-N
Mol Weight 550.6 g/mol
Molecular Formula C24H35IN2OSi2
Exact Mass 550.133262 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 50Ku3UOX7A
Name 5MT-NB3I 2TMS
Classification Designer drug
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Exact Mass 550.133261824 u
Formula C24H35N2OISi2
InChI InChI=1S/C24H35IN2OSi2/c1-28-22-11-12-24-23(16-22)20(18-27(24)30(5,6)7)13-14-26(29(2,3)4)17-19-9-8-10-21(25)15-19/h8-12,15-16,18H,13-14,17H2,1-7H3
InChIKey JRLAVPPCJXTUIN-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 550.631 g/mol
SMILES c1(cc2c(CCN([Si](C)(C)C)Cc3cccc(I)c3)c[n](c2cc1)[Si](C)(C)C)OC
SPLASH splash10-0159-2394000000-5f3f51a9cd6eacd43ead
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_9920