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(3S,5S)-2-amino-5-(2-chlorophenyl)-3-hydroxy-3-phenyl-1-cyclopentenecarbonitrile

View entire compound with spectra: 2 MS (GC)

(3S,5S)-2-amino-5-(2-chlorophenyl)-3-hydroxy-3-phenyl-1-cyclopentenecarbonitrile
SpectraBase Compound ID 7AGdvyV7GAC
InChI InChI=1S/C18H15ClN2O/c19-16-9-5-4-8-13(16)14-10-18(22,17(21)15(14)11-20)12-6-2-1-3-7-12/h1-9,14,22H,10,21H2/t14-,18+/m1/s1
InChIKey YWIUGAJWKIOQTC-KDOFPFPSSA-N
Mol Weight 310.78 g/mol
Molecular Formula C18H15ClN2O
Exact Mass 310.087291 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIYEsDsIri4
Name (3S,5S)-2-amino-5-(2-chlorophenyl)-3-hydroxy-3-phenyl-1-cyclopentenecarbonitrile
Alternate Name(s) (3S,5S)-2-amino-5-(2-chlorophenyl)-3-hydroxy-3-phenyl-cyclopentene-1-carbonitrile (3S,5S)-2-azanyl-5-(2-chlorophenyl)-3-oxidanyl-3-phenyl-cyclopentene-1-carbonitrile
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Formula C18H15ClN2O
InChI InChI=1S/C18H15ClN2O/c19-16-9-5-4-8-13(16)14-10-18(22,17(21)15(14)11-20)12-6-2-1-3-7-12/h1-9,14,22H,10,21H2/t14-,18+/m1/s1
InChIKey YWIUGAJWKIOQTC-KDOFPFPSSA-N
Molecular Weight 310.784 g/mol
SMILES O[C@@]1(C[C@@](C(=C1N)C#N)(c1c(Cl)cccc1)[H])c1ccccc1
SPLASH splash10-08fu-0398000000-a6a100a6b3b644c6c63b
Source of Spectrum KC-57-6932-2
Wiley ID 1625323