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(1'R,2'S)-3-[(1'-Cyano-2'-vinylcyclopropyl)imino]-2-hydroxypinan
SpectraBase Compound ID K8AHuHhOEyi
InChI InChI=1S/C16H22N2O/c1-5-10-8-16(10,9-17)18-13-7-11-6-12(14(11,2)3)15(13,4)19/h5,10-12,19H,1,6-8H2,2-4H3/b18-13+/t10-,11?,12?,15?,16+/m1/s1
InChIKey WQEXKFBTBUJIJQ-UEDLXMFJSA-N
Mol Weight 258.36 g/mol
Molecular Formula C16H22N2O
Exact Mass 258.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Dg2lBJNUiU
Name (1'R,2'S)-3-[(1'-Cyano-2'-vinylcyclopropyl)imino]-2-hydroxypinan
Comments Less than 3 mono-isotopic peaks
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Formula C16H22N2O
InChI InChI=1S/C16H22N2O/c1-5-10-8-16(10,9-17)18-13-7-11-6-12(14(11,2)3)15(13,4)19/h5,10-12,19H,1,6-8H2,2-4H3/b18-13+/t10-,11?,12?,15?,16+/m1/s1
InChIKey WQEXKFBTBUJIJQ-UEDLXMFJSA-N
Molecular Weight 258.365 g/mol
SMILES OC1(C2CC(C2(C)C)C\C1=N\[C@]1([C@](C=C)(C1)[H])C#N)C
SPLASH splash10-0006-9000000000-53a6f19a96c979d09278
Source of Spectrum SK-28-1359-4
Synonyms (1R,2S)-1-{[(3E)-2-hydroxy-2,6,6-trimethylbicyclo[3.1.1]hept-3-ylidene]amino}-2-vinylcyclopropanecarbonitrile (2' trans / cis)-3-[(1'-Cyano-2'-vinylcyclopropyl)imino]-2-hydroxypinan
Wiley ID 868325