4-Methoxybenzenesulfonyl chloride(98-68-0) IR2
Product Name4-Methoxybenzenesulfonyl chloride
CAS98-68-0
Molecular FormulaC7H7ClO3S
Molecular Weight206.65
InChIInChI=1S/C7H7ClO3S/c1-11-6-2-4-7(5-3-6)12(8,9)10/h2-5H,1H3
InChIKey DTJVECUKADWGMO-UHFFFAOYSA-N
SmilesC1(S(Cl)(=O)=O)=CC=C(OC)C=C1
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MassMS-IW-1569 p-methoxybenzenesulfonyl chloride C7H7ClO3S (Mass of molecular ion: 206)
Source Temperature: 260 °C Sample Temperature: 160 °C Reservoir, 75 eV
28.0 1.8 36.0 1.1 38.0 4.3 39.0 3.1 41.0 2.1 43.0 1.2 45.0 1.1 48.0 1.8 50.0 7.3 51.0 4.2 52.0 1.2 53.0 1.9 56.0 1.0 57.0 1.6 61.0 1.0 62.0 3.3 63.0 13.3 64.0 18.3 65.0 2.8 69.0 1.8 70.0 1.2 74.0 3.1 75.0 3.1 76.0 3.7 77.0 44.3 78.0 4.9 79.0 2.8 85.5 1.2 92.0 31.0 93.0 2.5 95.0 1.8 99.0 2.4 107.0 51.9 108.0 6.7 123.0 21.4 124.0 2.3 125.0 1.0 127.0 2.1 139.0 2.4 140.0 1.6 142.0 1.3 155.0 5.8 171.0 100.0 172.0 9.2 173.0 5.5 206.0 27.7 207.0 2.4 208.0 10.4 231.0 1.5 246.0 3.2
400MHZ in CDCl3
KBr disc
nujol mull
