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(+)-(1S,2S)-2-(4-Chlorophenyl)cyclopropanecarbonitrile
SpectraBase Compound ID 7MiiEwqjRMk
InChI InChI=1S/C10H8ClN/c11-9-3-1-7(2-4-9)10-5-8(10)6-12/h1-4,8,10H,5H2/t8-,10-/m1/s1
InChIKey KGMNEQVUSYEJHX-PSASIEDQSA-N
Mol Weight 177.63 g/mol
Molecular Formula C10H8ClN
Exact Mass 177.034527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dc1R8dS1wgI
Name (1S,2S)-2-(4-chlorophenyl)cyclopropane-1-carbonitrile
Appearance White solid
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Exact Mass 177.034526962 u
Formula C10H8ClN
InChI InChI=1S/C10H8ClN/c11-9-3-1-7(2-4-9)10-5-8(10)6-12/h1-4,8,10H,5H2/t8-,10-/m1/s1
InChIKey KGMNEQVUSYEJHX-PSASIEDQSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/anie.201810059
Molecular Weight 177.634 g/mol
Quality 13
SMILES C1(Cl)=CC=C(C=C1)[C@@]1([C@](C1)(C#N)[H])[H]
SPLASH splash10-014i-0900000000-c8af11b5aac6235e8af9
Source of Spectrum ACI-57-SM31-3a (DOI: 10.1002/anie.201810059)
Wiley ID 1893619