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3-acetoxy-3-(tert-butylcarbamoyl)pentanedioic acid
SpectraBase Compound ID Iya5p9jBfnJ
InChI InChI=1S/C12H19NO7/c1-7(14)20-12(5-8(15)16,6-9(17)18)10(19)13-11(2,3)4/h5-6H2,1-4H3,(H,13,19)(H,15,16)(H,17,18)
InChIKey UJSYWQJDUCSRJU-UHFFFAOYSA-N
Mol Weight 289.28 g/mol
Molecular Formula C12H19NO7
Exact Mass 289.116152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AKwhWIDL5te
Name 3-acetoxy-3-(tert-butylcarbamoyl)pentanedioic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO7
InChI InChI=1S/C12H19NO7/c1-7(14)20-12(5-8(15)16,6-9(17)18)10(19)13-11(2,3)4/h5-6H2,1-4H3,(H,13,19)(H,15,16)(H,17,18)
InChIKey UJSYWQJDUCSRJU-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 289.284 g/mol
SMILES N(C(C(CC(=O)O)(CC(=O)O)OC(C)=O)=O)C(C)(C)C
SPLASH splash10-074i-4930000000-ddd31e9b607353ab14ae
Source of Spectrum WO2010101477A1
Wiley ID 1844232