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Octanal, 1MEOX
SpectraBase Compound ID IGeEORO7oy1
InChI InChI=1S/C9H19NO/c1-3-4-5-6-7-8-9-10-11-2/h9H,3-8H2,1-2H3/b10-9-
InChIKey MNPSWFBVAFHEKP-KTKRTIGZSA-N
Mol Weight 157.26 g/mol
Molecular Formula C9H19NO
Exact Mass 157.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JAOou4ef0H9
Name Octanal, 1MEOX
Alternate Name(s) Octanal, 1MEOX Caprylaldehyde, 1MEOX 1-Octanal, 1MEOX Caprylic aldehyde, 1MEOX 1-Octylaldehyde, 1MEOX 1-Octaldehyde, 1MEOX (Z)-octanal O-methyl oxime
Comments Derivatization type: 1 MEOX (mass: 157.147); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000849; Note: The molecular formula of the structure shown is C8H16O - which differs from the formula reported for the mass spectrum (C9H19NO)
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Formula C9H19NO
InChI InChI=1S/C9H19NO/c1-3-4-5-6-7-8-9-10-11-2/h9H,3-8H2,1-2H3/b10-9-
InChIKey MNPSWFBVAFHEKP-KTKRTIGZSA-N
Molecular Weight 157.257 g/mol
SMILES CCCCCCC\C=N/OC
SPLASH splash10-000i-9200000000-13ad1ef3c14b4896d125
Source of Spectrum FM-2019-849-0
Wiley ID 1818523