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N-ACETYLPHANTASMIDINE;MAJOR_ISOMER
SpectraBase Compound ID 4eZb2AxDhUF
InChI InChI=1S/C13H13ClN2O2/c1-7(17)16-6-9-8-2-3-11(14)15-12(8)18-13(9)5-4-10(13)16/h2-3,9-10H,4-6H2,1H3/t9-,10-,13+/m0/s1
InChIKey VBHFZQVZRBYLPK-OUJBWJOFSA-N
Mol Weight 264.71 g/mol
Molecular Formula C13H13ClN2O2
Exact Mass 264.066555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5B1iJEW5G9
Name N- acetylphantasmidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClN2O2
InChI InChI=1S/C13H13ClN2O2/c1-7(17)16-6-9-8-2-3-11(14)15-12(8)18-13(9)5-4-10(13)16/h2-3,9-10H,4-6H2,1H3/t9-,10-,13+/m0/s1
InChIKey VBHFZQVZRBYLPK-OUJBWJOFSA-N
Instrument Name Finnigan GCQ??
Ionization Type EI
Reported Formula C13H13N2O2(35)Cl
SMILES C1[C@@]2([H])c3ccc(Cl)nc3O[C@]22CC[C@]2([H])N1C(C)=O
SPLASH splash10-0159-3950000000-da8481f069033c1fb8d8
Source of Spectrum WO2011116282A2
Wiley ID 1843007