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methyl 3-(3-chlorophenyl)prop-2-ynoate
SpectraBase Compound ID K42uM3khdYM
InChI InChI=1S/C10H7ClO2/c1-13-10(12)6-5-8-3-2-4-9(11)7-8/h2-4,7H,1H3
InChIKey PTGOHFYICMWCAG-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 Mv922SxpLP
Name methyl 3-(3-chlorophenyl)prop-2-ynoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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)6-5-8-3-2-4-9(11)7-8/h2-4,7H,1H3
InChIKey PTGOHFYICMWCAG-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 229
Reported Formula C10H7O2(35)Cl
SMILES COC(C#CC1=CC(=CC=C1)Cl)=O
SPLASH splash10-03di-0900000000-117ffe6b84890bb45318
Source of Spectrum QE-24-SM8-3g (DOI: 10.1002/chem.201800526)
Wiley ID 1900206