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2,4,6-Trimethylbenzaldehyde
SpectraBase Compound ID 5Ilk07g2CJy
InChI InChI=1S/C10H12O/c1-7-4-8(2)10(6-11)9(3)5-7/h4-6H,1-3H3
InChIKey HIKRJHFHGKZKRI-UHFFFAOYSA-N
Mol Weight 148.2 g/mol
Molecular Formula C10H12O
Exact Mass 148.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kyeXydgdFm
Name Benzaldehyde, 2,4,6-trimethyl- (D1)
CAS Registry Number 487-68-3
Comments Note: The molecular formula of the structure shown is C10H12O - which differs from the formula reported for the mass spectrum (C10H10D2O)
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Formula C10H10D2O
InChI InChI=1S/C10H12O/c1-7-4-8(2)10(6-11)9(3)5-7/h4-6H,1-3H3
InChIKey HIKRJHFHGKZKRI-UHFFFAOYSA-N
Molecular Weight 148.205 g/mol
SMILES Cc1cc(c(C=O)c(c1)C)C
SPLASH splash10-00dl-3900000000-6ae631f2da555dce1ce3
Source of Spectrum OS-6-315-0
Synonyms 2,4,6-Trimethylbenzaldehyde (D1) 2-Mesitylenecarboxaldehyde (D1) Mesitaldehyde (D1) Mesitylaldehyde (D1) Mesitylenecarboxaldehyde (D1)
Wiley ID 1145643