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SCOPOLAMINE-ARTIFACT 2
SpectraBase Compound ID 34YVVTXfIum
InChI InChI=1S/C8H13NO2/c1-9-5-2-4(10)3-6(9)8-7(5)11-8/h4-8,10H,2-3H2,1H3/t4-,5-,6+,7-,8+
InChIKey FIMXSEMBHGTNKT-RZVDLVGDSA-N
Mol Weight 155.2 g/mol
Molecular Formula C8H13NO2
Exact Mass 155.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xoWbi1Dua
Name Scopine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO2
InChI InChI=1S/C8H13NO2/c1-9-5-2-4(10)3-6(9)8-7(5)11-8/h4-8,10H,2-3H2,1H3/t4-,5-,6+,7-,8+
InChIKey FIMXSEMBHGTNKT-RZVDLVGDSA-N
Molecular Weight 155.197 g/mol
SMILES O[C@]1(C[C@@]2(N(C)[C@@]([C@@]3([C@]2(O3)[H])[H])(C1)[H])[H])[H]
SPLASH splash10-03ec-9600000000-d4fbacd80155c7637c7a
Source of Spectrum F-52-11990-1
Wiley ID 798597