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Methylbutyrate
SpectraBase Compound ID 6mr44CNbBix
InChI InChI=1S/C5H10O2/c1-3-4-5(6)7-2/h3-4H2,1-2H3
InChIKey UUIQMZJEGPQKFD-UHFFFAOYSA-N
Mol Weight 102.13 g/mol
Molecular Formula C5H10O2
Exact Mass 102.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlRx8gjGhW4
Name Methyl butyrate
CAS Registry Number 623-42-7
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 102.068079560 u
Formula C5H10O2
InChI InChI=1S/C5H10O2/c1-3-4-5(6)7-2/h3-4H2,1-2H3
InChIKey UUIQMZJEGPQKFD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 102.133 g/mol
Nominal Mass 102 u
Quality 995
Retention Index 690
SMILES C(CCC)(OC)=O
SPLASH splash10-00dl-9000000000-fd2a9b0c7987cd97758c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Butyric acid methyl ester Methyl-n-butyrate Methyl butanoate
Technique GC/MS
Wiley ID DD2024_033715