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(2S,3S)-1-isopropyl-3-phenyl-aziridine-2-carbonitrile
SpectraBase Compound ID 5rAJVgW4Fhj
InChI InChI=1S/C12H14N2/c1-9(2)14-11(8-13)12(14)10-6-4-3-5-7-10/h3-7,9,11-12H,1-2H3/t11-,12+,14?/m1/s1
InChIKey MRECTEHKJLKIJN-RJTITELWSA-N
Mol Weight 186.26 g/mol
Molecular Formula C12H14N2
Exact Mass 186.115698 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FvqOu6ciA0
Name (2S,3S)-1-isopropyl-3-phenyl-aziridine-2-carbonitrile
Alternate Name(s) (2S,3S)-1-isopropyl-3-phenyl-ethylenimine-2-carbonitrile (2S,3S)-3-phenyl-1-propan-2-yl-2-aziridinecarbonitrile (2S,3S)-3-phenyl-1-propan-2-yl-aziridine-2-carbonitrile
CAS Registry Number 116584-99-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2
InChI InChI=1S/C12H14N2/c1-9(2)14-11(8-13)12(14)10-6-4-3-5-7-10/h3-7,9,11-12H,1-2H3/t11-,12+,14?/m1/s1
InChIKey MRECTEHKJLKIJN-RJTITELWSA-N
Molecular Weight 186.258 g/mol
SMILES [C@]1(N([C@]1(c1ccccc1)[H])C(C)C)(C#N)[H]
SPLASH splash10-014l-1900000000-b04b8fa7e209e04f7b21
Source of Spectrum Y-25-358-2
Wiley ID 1183303