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4-Methylbenzaldehyde
SpectraBase Compound ID JupFSgpvHLd
InChI InChI=1S/C8H8O/c1-7-2-4-8(6-9)5-3-7/h2-6H,1H3
InChIKey FXLOVSHXALFLKQ-UHFFFAOYSA-N
Mol Weight 120.15 g/mol
Molecular Formula C8H8O
Exact Mass 120.057515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbEuQI9CKJj
Name Benzaldehyde, 4-methyl-
Alternate Name(s) 4-Methylbenzaldehyde 4-Tolualdehyde 4-Toluylaldehyde p-Formyltoluene p-Methylbenzaldehyde p-Tolualdehyde Para-methylbenzaldehyde Para-tolualdehyde Para-toluyl aldehyde Paratolualdehyde PTAL AI3-24380 CCRIS 2942 EINECS 203-246-9 HSDB 5361 NSC 2224
CAS Registry Number 104-87-0
Comments Less than 3 mono-isotopic peaks
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Formula C8H8O
InChI InChI=1S/C8H8O/c1-7-2-4-8(6-9)5-3-7/h2-6H,1H3
InChIKey FXLOVSHXALFLKQ-UHFFFAOYSA-N
Molecular Weight 120.151 g/mol
SMILES C(=O)c1ccc(cc1)C
SPLASH splash10-0006-9800000000-4d8d567381d8f680af27
Source of Spectrum Y1-45-8109-3
Wiley ID 1622275