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(S,E)-3-(phenylimino)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
SpectraBase Compound ID DJzLjHuCVXk
InChI InChI=1S/C12H13N3O/c16-11-10-7-4-8-15(10)12(14-11)13-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2,(H,13,14,16)/t10-/m0/s1
InChIKey XSOODJOWQJGFGM-JTQLQIEISA-N
Mol Weight 215.26 g/mol
Molecular Formula C12H13N3O
Exact Mass 215.105862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLECUQBRvc4
Name (S,E)-3-(phenylimino)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Alternate Name(s) (7aS)-3-anilino-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-1-one (7aS)-3-phenylazanyl-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3O
InChI InChI=1S/C12H13N3O/c16-11-10-7-4-8-15(10)12(14-11)13-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2,(H,13,14,16)/t10-/m0/s1
InChIKey XSOODJOWQJGFGM-JTQLQIEISA-N
Molecular Weight 215.256 g/mol
SMILES N1C([C@]2(N(\C1=N/c1ccccc1)CCC2)[H])=O
SPLASH splash10-014i-1920000000-588ebc1287f17a85c39f
Source of Spectrum U1-2012-2547-6c
Wiley ID 1715371