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Methyl 2-tosylbenzoate
SpectraBase Compound ID E7E0th6QNqI
InChI InChI=1S/C15H14O4S/c1-11-7-9-12(10-8-11)20(17,18)14-6-4-3-5-13(14)15(16)19-2/h3-10H,1-2H3
InChIKey OZBJPKKHSKFGTP-UHFFFAOYSA-N
Mol Weight 290.33 g/mol
Molecular Formula C15H14O4S
Exact Mass 290.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C09c14Z6cx5
Name Methyl 2-tosylbenzoate
Appearance Colorless oil
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Exact Mass 290.061280101 u
Formula C15H14O4S
InChI InChI=1S/C15H14O4S/c1-11-7-9-12(10-8-11)20(17,18)14-6-4-3-5-13(14)15(16)19-2/h3-10H,1-2H3
InChIKey OZBJPKKHSKFGTP-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201711104
Quality 230
Reported Formula C15H14O4S
SMILES C1=CC(=C(C=C1)C(OC)=O)S(C1=CC=C(C=C1)C)(=O)=O
SPLASH splash10-056s-1890000000-1f119da1bf46986caf94
Source of Spectrum ACI-57-SM6-3g (DOI: 10.1002/anie.201711104)
Wiley ID 1891169