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Methylester of 5-Benzyloxy-1-[13C]-pentanoic acid
SpectraBase Compound ID CPSwv3bagvi
InChI InChI=1S/C13H18O3/c1-15-13(14)9-5-6-10-16-11-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3/i12+1
InChIKey MEOZGFLFCCOURF-HNHCFKFXSA-N
Mol Weight 223.28 g/mol
Molecular Formula C1213CH18O3
Exact Mass 223.128949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WyCf9hFetw
Name Methylester of 5-Benzyloxy-1-[13C]-pentanoic acid
Comments Original formula: C12[13C]H18O3
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Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-15-13(14)9-5-6-10-16-11-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3/i12+1
InChIKey MEOZGFLFCCOURF-HNHCFKFXSA-N
Molecular Weight 223.276 g/mol
SMILES C(=O)(OC)CCCCOC[13c]1ccccc1
SPLASH splash10-0006-9200000000-07e863010cbe56f03bba
Source of Spectrum F-38-1655-0
Wiley ID 1222690