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1H-Imidazole-4-acetonitrile, 2-methyl-5-t-butoxycarbonylamino-

View entire compound with spectra: 2 MS (GC)

1H-Imidazole-4-acetonitrile, 2-methyl-5-t-butoxycarbonylamino-
SpectraBase Compound ID KiypV25zZUe
InChI InChI=1S/C11H16N4O2/c1-7-13-8(5-6-12)9(14-7)15-10(16)17-11(2,3)4/h5H2,1-4H3,(H,13,14)(H,15,16)
InChIKey ZKVLFMDJTWHMHS-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C11H16N4O2
Exact Mass 236.127326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H9ahG3aZyl1
Name 1H-Imidazole-4-acetonitrile, 2-methyl-5-t-butoxycarbonylamino-
Alternate Name(s) N-[5-(cyanomethyl)-2-methyl-1H-imidazol-4-yl]carbamic acid tert-butyl ester tert-Butyl 4-(cyanomethyl)-2-methyl-1H-imidazol-5-ylcarbamate tert-Butyl N-[5-(cyanomethyl)-2-methyl-1H-imidazol-4-yl]carbamate
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Formula C11H16N4O2
InChI InChI=1S/C11H16N4O2/c1-7-13-8(5-6-12)9(14-7)15-10(16)17-11(2,3)4/h5H2,1-4H3,(H,13,14)(H,15,16)
InChIKey ZKVLFMDJTWHMHS-UHFFFAOYSA-N
Molecular Weight 236.275 g/mol
SMILES N(C(OC(C)(C)C)=O)c1c(nc([nH]1)C)CC#N
SPLASH splash10-0a4u-9400000000-0cc11d46481eb92e518e
Wiley ID 1482426