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Decanoic acid
SpectraBase Compound ID 2qGx9EIG7Zs
InChI InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)
InChIKey GHVNFZFCNZKVNT-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JYN12nGIi
Name Capric acid
CAS Registry Number 334-48-5
Classification Fatty acid
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Exact Mass 172.146329882 u
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)
InChIKey GHVNFZFCNZKVNT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 172.268 g/mol
SMILES C(=O)(O)CCCCCCCCC
SPLASH splash10-074i-9100000000-028bf451da168d856c7a
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_5629