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L-isoleucine-methyl ester-carbamoyl cyanide
SpectraBase Compound ID GEhxO5jtbHT
InChI InChI=1S/C9H14N2O3/c1-4-6(2)8(9(13)14-3)11-7(12)5-10/h6,8H,4H2,1-3H3,(H,11,12)
InChIKey BVPGFECXZVKUAM-UHFFFAOYSA-N
Mol Weight 198.22 g/mol
Molecular Formula C9H14N2O3
Exact Mass 198.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4jDWFIaiye
Name L-isoleucine-methyl ester-carbamoyl cyanide
Alternate Name(s) Methyl 2-[(cyanocarbonyl)amino]-3-methylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14N2O3
InChI InChI=1S/C9H14N2O3/c1-4-6(2)8(9(13)14-3)11-7(12)5-10/h6,8H,4H2,1-3H3,(H,11,12)
InChIKey BVPGFECXZVKUAM-UHFFFAOYSA-N
Molecular Weight 198.222 g/mol
SMILES N(C(C(=O)OC)C(CC)C)C(C#N)=O
SPLASH splash10-02tl-2900000000-8e1643433d07fc238045
Source of Spectrum F5-7-3996-8q
Wiley ID 1696751