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N-Capryloyl-glycine methyl ester
SpectraBase Compound ID BClxJWpAxQC
InChI InChI=1S/C9H19NO2/c1-3-4-5-6-7-10-8-9(11)12-2/h10H,3-8H2,1-2H3
InChIKey QKQSVBZXFMRFBV-UHFFFAOYSA-N
Mol Weight 173.26 g/mol
Molecular Formula C9H19NO2
Exact Mass 173.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UDtRRoc0Ya
Name N-Capryloyl-glycine methyl ester
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 173.141578854 u
Formula C9H19NO2
InChI InChI=1S/C9H19NO2/c1-3-4-5-6-7-10-8-9(11)12-2/h10H,3-8H2,1-2H3
InChIKey QKQSVBZXFMRFBV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 173.256 g/mol
Nominal Mass 173 u
Quality 803
Retention Index 1300
SMILES C(NCCCCCC)C(OC)=O
SPLASH splash10-053r-7900000000-3e0a7d6d4f53e662b1ae
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms methyl (hexylamino)acetate
Technique GC/MS
Wiley ID DD2024_007042