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Diiodomescaline
SpectraBase Compound ID BuNx5aLeEkp
InChI InChI=1S/C11H15I2NO3/c1-15-9-7(12)6(4-5-14)8(13)10(16-2)11(9)17-3/h4-5,14H2,1-3H3
InChIKey HBHDZMOTBIMMQM-UHFFFAOYSA-N
Mol Weight 463.05 g/mol
Molecular Formula C11H15I2NO3
Exact Mass 462.914133 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Acq0ro2B4FA
Name Diiodomescaline
Classification Drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 462.914133344 u
Formula C11H15I2NO3
InChI InChI=1S/C11H15I2NO3/c1-15-9-7(12)6(4-5-14)8(13)10(16-2)11(9)17-3/h4-5,14H2,1-3H3
InChIKey HBHDZMOTBIMMQM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 463.054 g/mol
Nominal Mass 463 u
Quality 975
Retention Index 2314
SMILES NCCC1=C(C(=C(C(=C1I)OC)OC)OC)I
SPLASH splash10-059l-1595000000-ed164aa246a29dab3a65
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-(2,6-diiodo-3,4,5-trimethoxyphenyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_005975