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Pentanoic acid, 5-[bis(cyanomethyl)amino]-5-oxo-
SpectraBase Compound ID H3UftRZtKXG
InChI InChI=1S/C9H11N3O3/c10-4-6-12(7-5-11)8(13)2-1-3-9(14)15/h1-3,6-7H2,(H,14,15)
InChIKey NPUXXLJXQZJQBY-UHFFFAOYSA-N
Mol Weight 209.2 g/mol
Molecular Formula C9H11N3O3
Exact Mass 209.080041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DHDgXNkJpl
Name Pentanoic acid, 5-[bis(cyanomethyl)amino]-5-oxo-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11N3O3
InChI InChI=1S/C9H11N3O3/c10-4-6-12(7-5-11)8(13)2-1-3-9(14)15/h1-3,6-7H2,(H,14,15)
InChIKey NPUXXLJXQZJQBY-UHFFFAOYSA-N
Molecular Weight 209.205 g/mol
SMILES OC(=O)CCCC(=O)N(CC#N)CC#N
SPLASH splash10-00kg-9300000000-908c84f58127e3191b28
Source of Spectrum JX-2015-5-979
Synonyms 5-(bis(cyanomethyl)amino)-5-oxopentanoic acid 5-[bis(cyanomethyl)amino]-5-oxopentanoic acid 5-[bis(cyanomethyl)amino]-5-oxo-pentanoic acid 5-[bis(cyanomethyl)amino]-5-oxidanylidene-pentanoic acid
Wiley ID 1727704