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N-[2-(cyanomethylamino)-2-keto-ethyl]carbamic acid tert-butyl ester
SpectraBase Compound ID 278UHRkG6cH
InChI InChI=1S/C9H15N3O3/c1-9(2,3)15-8(14)12-6-7(13)11-5-4-10/h5-6H2,1-3H3,(H,11,13)(H,12,14)
InChIKey XPPHLZBEBMODOV-UHFFFAOYSA-N
Mol Weight 213.24 g/mol
Molecular Formula C9H15N3O3
Exact Mass 213.111341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5CnGjZtsrtX
Name N-[2-(cyanomethylamino)-2-keto-ethyl]carbamic acid tert-butyl ester
CAS Registry Number 109924-25-6
Comments Less than 3 mono-isotopic peaks
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Formula C9H15N3O3
InChI InChI=1S/C9H15N3O3/c1-9(2,3)15-8(14)12-6-7(13)11-5-4-10/h5-6H2,1-3H3,(H,11,13)(H,12,14)
InChIKey XPPHLZBEBMODOV-UHFFFAOYSA-N
Molecular Weight 213.237 g/mol
SMILES N(C(OC(C)(C)C)=O)CC(=O)NCC#N
SPLASH splash10-0a4i-9000000000-bcbf1e209022a47eb07a
Source of Spectrum H-69-1251-4
Synonyms N-[2-(cyanomethylamino)-2-oxoethyl]carbamic acid tert-butyl ester tert-butyl N-[2-(cyanomethylamino)-2-oxidanylidene-ethyl]carbamate tert-butyl N-[2-(cyanomethylamino)-2-oxo-ethyl]carbamate
Wiley ID 1212392