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Hexanal, 2-ethyl-2-methyl-5-oxo-
SpectraBase Compound ID 7Ri5nmWiAfE
InChI InChI=1S/C9H16O2/c1-4-9(3,7-10)6-5-8(2)11/h7H,4-6H2,1-3H3
InChIKey AFAFNVOVWBSJMA-UHFFFAOYSA-N
Mol Weight 156.22 g/mol
Molecular Formula C9H16O2
Exact Mass 156.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Y0VXJOCv8Z
Name Hexanal, 2-ethyl-2-methyl-5-oxo-
Alternate Name(s) 2-Ethyl-2-methyl-5-oxohexanal 2-ethyl-2-methyl-5-oxo-hexanal 2-ethyl-2-methyl-5-oxidanylidene-hexanal
CAS Registry Number 70105-73-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-4-9(3,7-10)6-5-8(2)11/h7H,4-6H2,1-3H3
InChIKey AFAFNVOVWBSJMA-UHFFFAOYSA-N
Molecular Weight 156.225 g/mol
SMILES C(C=O)(CCC(=O)C)(CC)C
SPLASH splash10-000i-0900000000-8eaba95818ed540d8bf9
Source of Spectrum KC-1984-123-0
Wiley ID 1153659