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3-Oxapentane-1,4-dione, 1-(2'-(octanoylamino)phenyl)-

View entire compound with spectra: 2 MS (GC)

3-Oxapentane-1,4-dione, 1-(2'-(octanoylamino)phenyl)-
SpectraBase Compound ID 72exF1uOxSL
InChI InChI=1S/C18H25NO4/c1-3-4-5-6-7-12-18(22)19-16-11-9-8-10-15(16)17(21)13-23-14(2)20/h8-11H,3-7,12-13H2,1-2H3,(H,19,22)
InChIKey JQNFSIHQPHNRNX-UHFFFAOYSA-N
Mol Weight 319.4 g/mol
Molecular Formula C18H25NO4
Exact Mass 319.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHVo3mQxrIJ
Name 3-OXAPENTA-1,4-DIONE, 1-(2'-(OCTANOYLAMINO)PHENYL)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H25NO4
InChI InChI=1S/C18H25NO4/c1-3-4-5-6-7-12-18(22)19-16-11-9-8-10-15(16)17(21)13-23-14(2)20/h8-11H,3-7,12-13H2,1-2H3,(H,19,22)
InChIKey JQNFSIHQPHNRNX-UHFFFAOYSA-N
Molecular Weight 319.1777
SMILES N(C(CCCCCCC)=O)c1ccccc1C(COC(C)=O)=O
SPLASH splash10-006w-4950000000-753ea58f09f8b2511fbd
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany