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cis-2-Amino-3-cyano-1-(p-methylphenyl)-4-(p-chlorophenyl)-2-cyclopentene-1-ol
SpectraBase Compound ID EZUOUTjWjcr
InChI InChI=1S/C19H17ClN2O/c1-12-2-6-14(7-3-12)19(23)10-16(17(11-21)18(19)22)13-4-8-15(20)9-5-13/h2-9,16,23H,10,22H2,1H3/t16-,19+/m1/s1
InChIKey JTGCYMMHJDLMKT-APWZRJJASA-N
Mol Weight 324.81 g/mol
Molecular Formula C19H17ClN2O
Exact Mass 324.102941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JoZErOQqG6l
Name cis-2-Amino-3-cyano-1-(p-methylphenyl)-4-(p-chlorophenyl)-2-cyclopentene-1-ol
Alternate Name(s) (3S,5R)-2-amino-5-(4-chlorophenyl)-3-hydroxy-3-(4-methylphenyl)-1-cyclopentene-1-carbonitrile cis-2-Amino-4-(4-chlorophenyl)-3-cyano-1-(p-tolyl)cyclopent-2-en-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17ClN2O
InChI InChI=1S/C19H17ClN2O/c1-12-2-6-14(7-3-12)19(23)10-16(17(11-21)18(19)22)13-4-8-15(20)9-5-13/h2-9,16,23H,10,22H2,1H3/t16-,19+/m1/s1
InChIKey JTGCYMMHJDLMKT-APWZRJJASA-N
Molecular Weight 324.811 g/mol
SMILES O[C@@]1(C[C@@](C(=C1N)C#N)(c1ccc(cc1)Cl)[H])c1ccc(cc1)C
SPLASH splash10-0a4i-2369000000-4dad985388c23b48cde6
Source of Spectrum SO-0-95-13
Wiley ID 877289