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methyl 3-(o-tolyl)prop-2-ynoate
SpectraBase Compound ID 82yFGHScPj2
InChI InChI=1S/C11H10O2/c1-9-5-3-4-6-10(9)7-8-11(12)13-2/h3-6H,1-2H3
InChIKey PYEFBLSKCJMIBB-UHFFFAOYSA-N
Mol Weight 174.2 g/mol
Molecular Formula C11H10O2
Exact Mass 174.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rCKLTHusJ9
Name methyl 3-(o-tolyl)prop-2-ynoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10O2
GC Column HP-5
GC Oven Program Oven temp 300oC
InChI InChI=1S/C11H10O2/c1-9-5-3-4-6-10(9)7-8-11(12)13-2/h3-6H,1-2H3
InChIKey PYEFBLSKCJMIBB-UHFFFAOYSA-N
Instrument Name GC-MS Agilent 5977B MSD
Ionization Type EI
Literature Reference DOI 10.1002/chem.201800526
Molecular Weight 174.199 g/mol
Quality 115
SMILES COC(C#CC1=C(C=CC=C1)C)=O
SPLASH splash10-014l-0900000000-531937210b6ede022c06
Source of Spectrum QE-24-SM7-3b (DOI: 10.1002/chem.201800526)
Wiley ID 1900201