METHYL 4-CHLOROCINNAMATE(7560-44-3) MS
Product NameMETHYL 4-CHLOROCINNAMATE
CAS7560-44-3
Molecular FormulaC10H9ClO2
Molecular Weight196.63
InChIInChI=1S/C10H9ClO2/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7H,1H3
InChIKey IIBXQGYKZKOORG-UHFFFAOYSA-N
SmilesC(OC)(=O)C=CC1=CC=C(Cl)C=C1
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MassMS2004-02530WA 4-chlorocinnamic acid methyl ester C10H9ClO2 (Mass of molecular ion: 196)
Source Temperature: 140 °C Sample Temperature: 120 °C Direct, 70 eV
15.0 1.4 28.0 1.1 39.0 1.2 50.0 8.1 50.5 1.4 51.0 17.1 52.0 1.3 59.0 1.4 61.0 1.0 62.0 1.5 63.0 2.8 68.0 1.3 68.5 2.3 69.0 1.1 73.0 1.2 74.0 5.3 75.0 17.9 76.0 5.3 77.0 1.7 82.5 2.1 85.0 2.5 89.0 1.3 98.0 1.2 99.0 1.5 100.0 1.3 101.0 26.5 102.0 30.1 103.0 4.5 111.0 2.8 113.0 1.0 115.0 1.7 125.0 2.1 131.0 1.9 133.0 1.6 136.0 7.2 137.0 35.0 138.0 7.8 139.0 12.2 140.0 1.9 151.0 2.2 153.0 1.3 155.0 1.4 161.0 2.3 164.0 1.7 165.0 100.0 166.0 10.3 167.0 32.7 168.0 4.4 178.0 1.3 181.0 1.0 195.0 6.5 196.0 53.6 197.0 8.3 198.0 17.9 199.0 2.0
KBr disk
Nujol
