Furfuryl methyl sulfide(1438-91-1) 13C NMR
Product NameFurfuryl methyl sulfide
CAS1438-91-1
Molecular FormulaC6H8OS
Molecular Weight128.19
InChIInChI=1S/C6H8OS/c1-8-5-6-3-2-4-7-6/h2-4H,5H2,1H3
InChIKey SKSFHXVDHVKIBN-UHFFFAOYSA-N
SmilesO1C=CC=C1CSC
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MassMS-NW-8595 furfuryl methyl sulfide C6H8OS (Mass of molecular ion: 128)
Source Temperature: 250 °C Sample Temperature: 140 °C Reservoir, 75 eV
26.0 1.1 27.0 10.0 29.0 1.5 38.0 1.3 39.0 3.5 45.0 8.1 46.0 1.6 47.0 2.9 50.0 2.9 51.0 5.8 52.0 4.1 53.0 39.1 54.0 2.0 58.0 1.3 61.0 1.5 65.0 1.0 81.0 100.0 82.0 6.0 84.0 1.2 85.0 1.6 127.0 1.1 128.0 39.1 129.0 3.0 130.0 1.9
90 MHz in CDCl3
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1H NMR 89.56 MHz C6 H8 O S 0.05 ml : 0.5 ml CDCl3 furfuryl methyl sulfide 
Assign. Shift(ppm)
A 7.344 B 6.290 C 6.166 D 3.664 E 2.059
Hz ppm Int.659.13 7.360 125 658.25 7.350 121 657.25 7.339 124 656.38 7.329 110 566.19 6.322 66 564.31 6.301 70 563.06 6.287 100 561.19 6.267 92 554.50 6.192 61 553.81 6.184 110 553.00 6.175 101 552.25 6.167 52 550.63 6.149 68 549.88 6.140 61 549.06 6.131 31 328.19 3.665 368 184.44 2.060 1000
in CDCl3
liquid film
