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methyl 3-(4-chlorophenyl)prop-2-ynoate
SpectraBase Compound ID EOPCHVdZcJK
InChI InChI=1S/C10H7ClO2/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-3,5-6H,1H3
InChIKey VAAXQAIHXHGPPC-UHFFFAOYSA-N
Mol Weight 194.62 g/mol
Molecular Formula C10H7ClO2
Exact Mass 194.013457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ft2oLjXxVUW
Name methyl 3-(4-chlorophenyl)prop-2-ynoate
Appearance Pale yellow needles
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Exact Mass 194.013457163 u
Formula C10H7ClO2
GC Column HP-5
GC Oven Program Oven temp 300oC
InChI InChI=1S/C10H7ClO2/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-3,5-6H,1H3
InChIKey VAAXQAIHXHGPPC-UHFFFAOYSA-N
Instrument Name GC-MS Agilent 5977B MSD
Ionization Type EI
Literature Reference DOI 10.1002/chem.201800526
Molecular Weight 194.617 g/mol
Quality 343
SMILES COC(C#CC1=CC=C(C=C1)Cl)=O
SPLASH splash10-03di-1900000000-ceb4f2a783ddbfeae8ec
Source of Spectrum QE-24-SM9-3l (DOI: 10.1002/chem.201800526)
Wiley ID 1900211