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2-chloro-3-methylcyclohexa-1,3-diene-1-carbaldehyde
SpectraBase Compound ID cqbx93XCdW
InChI InChI=1S/C8H9ClO/c1-6-3-2-4-7(5-10)8(6)9/h3,5H,2,4H2,1H3
InChIKey DLTIWAMCFOFUDY-UHFFFAOYSA-N
Mol Weight 156.61 g/mol
Molecular Formula C8H9ClO
Exact Mass 156.034193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KMSO6FRurDe
Name 1,3-Cyclohexadiene-1-carboxaldehyde, 2-chloro-3-methyl-
Alternate Name(s) 2-chloranyl-3-methyl-cyclohexa-1,3-diene-1-carbaldehyde 2-chloro-3-methyl-1-cyclohexa-1,3-dienecarboxaldehyde 2-chloro-3-methyl-cyclohexa-1,3-diene-1-carbaldehyde
CAS Registry Number 108035-74-1
Comments Less than 3 mono-isotopic peaks
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Formula C8H9ClO
InChI InChI=1S/C8H9ClO/c1-6-3-2-4-7(5-10)8(6)9/h3,5H,2,4H2,1H3
InChIKey DLTIWAMCFOFUDY-UHFFFAOYSA-N
Molecular Weight 156.612 g/mol
SMILES C1(=C(C=O)CCC=C1C)Cl
SPLASH splash10-0ab9-0900000000-b78a1e0370bc01da6d83
Source of Spectrum J-52-2733-13
Wiley ID 1153334