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Pentamethylbenzaldehyde
SpectraBase Compound ID HzN6Ou2zvU0
InChI InChI=1S/C12H16O/c1-7-8(2)10(4)12(6-13)11(5)9(7)3/h6H,1-5H3
InChIKey RWOZGGOKRKSHKN-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3KYLf9ihTWD
Name 2,3,4,5,6-Pentamethylbenzaldehyde
CAS Registry Number 17432-38-1
Comments Less than 3 mono-isotopic peaks
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Formula C12H16O
InChI InChI=1S/C12H16O/c1-7-8(2)10(4)12(6-13)11(5)9(7)3/h6H,1-5H3
InChIKey RWOZGGOKRKSHKN-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES Cc1c(c(c(C=O)c(c1C)C)C)C
SPLASH splash10-004i-0900000000-5559f006727ca4180cd2
Source of Spectrum J-54-1702-0
Synonyms Pentamethylbenzaldehyde
Wiley ID 1172763