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Hexanal

View entire compound with spectra: 2 NMR, 14 FTIR, 2 Raman, 36 MS (GC), and 2 Near IR

Hexanal
SpectraBase Compound ID FpCzP9TtO5P
InChI InChI=1S/C6H12O/c1-2-3-4-5-6-7/h6H,2-5H2,1H3
InChIKey JARKCYVAAOWBJS-UHFFFAOYSA-N
Mol Weight 100.16 g/mol
Molecular Formula C6H12O
Exact Mass 100.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FG3bDNqyPRb
Name Hexanal
Alternate Name(s) 1-Hexanal Aldehyde C-6 C6 aldehyde Caproaldehyde Caproic aldehyde Capronaldehyde Hexan-1-al Hexanaldehyde Hexoic aldehyde Hexylaldehyde Kapronaldehyd N-C5H11CHO n-Caproaldehyde n-Caproic aldehyde n-Capronaldehyde n-Caproylaldehyde n-Hexaldehyde n-Hexanal Hexaldehyde AI3-15364 BRN 0506198 CCRIS 3219 EINECS 200-624-5 FEMA NO. 2557 HSDB 560 NSC 2596 UN1207
CAS Registry Number 66-25-1
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Formula C6H12O
InChI InChI=1S/C6H12O/c1-2-3-4-5-6-7/h6H,2-5H2,1H3
InChIKey JARKCYVAAOWBJS-UHFFFAOYSA-N
Molecular Weight 100.161 g/mol
SMILES CCCCCC=O
SPLASH splash10-0abc-9000000000-66944d939ee657a06a35
Source of Spectrum O-23-383-12
Wiley ID 1119560