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3-(2-Chloromethylphenyl)-2,2-dimethylpropionaldehyde
SpectraBase Compound ID DDH6oxj1t0w
InChI InChI=1S/C12H15ClO/c1-12(2,9-14)7-10-5-3-4-6-11(10)8-13/h3-6,9H,7-8H2,1-2H3
InChIKey OTVSBZWZQDDTMC-UHFFFAOYSA-N
Mol Weight 210.7 g/mol
Molecular Formula C12H15ClO
Exact Mass 210.081143 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lgv4lJJOrk6
Name 3-(2-Chloromethylphenyl)-2,2-dimethylpropionaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C12H15ClO
InChI InChI=1S/C12H15ClO/c1-12(2,9-14)7-10-5-3-4-6-11(10)8-13/h3-6,9H,7-8H2,1-2H3
InChIKey OTVSBZWZQDDTMC-UHFFFAOYSA-N
Molecular Weight 210.704 g/mol
SMILES C(C(Cc1c(cccc1)CCl)(C)C)=O
SPLASH splash10-000i-0900000000-9cb78e1d0ac7216974d9
Source of Spectrum F-69-1937-45
Synonyms 3-[2-(chloromethyl)phenyl]-2,2-dimethylpropanal
Wiley ID 1594754