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Methyl 2-acetamido-3,3-dimethylbutanoate
SpectraBase Compound ID 4KIzK9E8XoS
InChI InChI=1S/C9H17NO3/c1-6(11)10-7(8(12)13-5)9(2,3)4/h7H,1-5H3,(H,10,11)
InChIKey MNKLWOGVQOMQHS-UHFFFAOYSA-N
Mol Weight 187.24 g/mol
Molecular Formula C9H17NO3
Exact Mass 187.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bJvsvU7sm
Name Methyl 2-acetamido-3,3-dimethylbutanoate
CAS Registry Number 143005-55-4
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 187.120843408 u
Formula C9H17NO3
InChI InChI=1S/C9H17NO3/c1-6(11)10-7(8(12)13-5)9(2,3)4/h7H,1-5H3,(H,10,11)
InChIKey MNKLWOGVQOMQHS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 187.239 g/mol
Nominal Mass 187 u
Quality 845
Retention Index 1358
SMILES C(NC(=O)C)(C(C)(C)C)C(OC)=O
SPLASH splash10-0012-9300000000-11c460e34ffa82461e2d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Methyl N-acetyl-3-methyl-L-valinate
Technique GC/MS
Wiley ID DD2024_022565