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3-[(1S,2R)-2-(3-ketobutyl)-3,3-dimethyl-cyclobutyl]but-3-enyl-methyl-cyanamide
SpectraBase Compound ID EGiKaDbW58B
InChI InChI=1S/C16H26N2O/c1-12(8-9-18(5)11-17)14-10-16(3,4)15(14)7-6-13(2)19/h14-15H,1,6-10H2,2-5H3/t14-,15-/m1/s1
InChIKey ISODQYNEEAEGCB-HUUCEWRRSA-N
Mol Weight 262.4 g/mol
Molecular Formula C16H26N2O
Exact Mass 262.204513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3O5xCSjQsCZ
Name 3-[(1S,2R)-2-(3-ketobutyl)-3,3-dimethyl-cyclobutyl]but-3-enyl-methyl-cyanamide
Alternate Name(s) 3-[(1S,2R)-3,3-dimethyl-2-(3-oxidanylidenebutyl)cyclobutyl]but-3-enyl-methyl-cyanamide 3-[(1S,2R)-3,3-dimethyl-2-(3-oxobutyl)cyclobutyl]but-3-enyl-methylcyanamide
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Formula C16H26N2O
InChI InChI=1S/C16H26N2O/c1-12(8-9-18(5)11-17)14-10-16(3,4)15(14)7-6-13(2)19/h14-15H,1,6-10H2,2-5H3/t14-,15-/m1/s1
InChIKey ISODQYNEEAEGCB-HUUCEWRRSA-N
Molecular Weight 262.397 g/mol
SMILES [C@@]1([C@](CCC(=O)C)([H])C(C1)(C)C)(C(CCN(C#N)C)=C)[H]
SPLASH splash10-0pc1-0980000000-cc831259aade4ba15fd7
Source of Spectrum SO-0-1157-27
Wiley ID 877920