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(S)-2,6-dimethylheptan-4-yl cyano(phenyl)methylcarbamate
SpectraBase Compound ID 6oypRlh0IR3
InChI InChI=1S/C18H26N2O2/c1-13(2)10-16(11-14(3)4)22-18(21)20-17(12-19)15-8-6-5-7-9-15/h5-9,13-14,16-17H,10-11H2,1-4H3,(H,20,21)/t17-/m1/s1
InChIKey SPFYEDAPWJJJAZ-QGZVFWFLSA-N
Mol Weight 302.42 g/mol
Molecular Formula C18H26N2O2
Exact Mass 302.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ix9vedJXsbE
Name (S)-2,6-dimethylheptan-4-yl cyano(phenyl)methylcarbamate
Alternate Name(s) (S)-2,6-dimethylheptan-4-yl (cyano(phenyl)methyl)carbamate
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Formula C18H26N2O2
InChI InChI=1S/C18H26N2O2/c1-13(2)10-16(11-14(3)4)22-18(21)20-17(12-19)15-8-6-5-7-9-15/h5-9,13-14,16-17H,10-11H2,1-4H3,(H,20,21)/t17-/m1/s1
InChIKey SPFYEDAPWJJJAZ-QGZVFWFLSA-N
Literature Reference DOI 10.1002/adsc.200800798
Molecular Weight 302.418 g/mol
SMILES N([C@@](c1ccccc1)(C#N)[H])C(=O)OC(CC(C)C)CC(C)C
SPLASH splash10-0006-9300000000-123c47faf4bcbd2615ee
Source of Spectrum ASC-351-1019/SM7-8b
Wiley ID 1763727