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[18O]-2-propylpentanoic acid

View entire compound with spectra: 1 MS (GC)

[18O]-2-propylpentanoic acid
SpectraBase Compound ID B5bbN6VKzYn
InChI InChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)/i9+2
InChIKey NIJJYAXOARWZEE-FOQJRBATSA-N
Mol Weight 146.21 g/mol
Molecular Formula C8H16O18O
Exact Mass 146.119275 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HEJwHbCoClG
Name [18O]-2-propylpentanoic acid
Alternate Name(s) 2-Propylpentanoic acid, 18O isotopic labeled
Comments Original formula: C8H16O[18O]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O2
InChI InChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)/i9+2
InChIKey NIJJYAXOARWZEE-FOQJRBATSA-N
Molecular Weight 146.214 g/mol
SMILES OC(C(CCC)CCC)=[18O]
SPLASH splash10-056r-9200000000-b3c9d0d45d5b7c11ec5d
Wiley ID 1481859