1-Adamantanecarbonyl chloride(2094-72-6) IR2
Product Name1-Adamantanecarbonyl chloride
CAS2094-72-6
Molecular FormulaC11H15ClO
Molecular Weight198.69
InChIInChI=1S/C11H15ClO/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9H,1-6H2
InChIKey MIBQYWIOHFTKHD-UHFFFAOYSA-N
SmilesC(Cl)(C12CC3CC(CC(C3)C1)C2)=O
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MassMS-NW-9012 1-adamantanecarbonyl chloride C11H15ClO (Mass of molecular ion: 198)
Source Temperature: 260 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 1.2 39.0 2.8 41.0 3.7 53.0 1.8 55.0 2.8 65.0 1.7 67.0 5.9 69.0 1.5 77.0 4.6 78.0 1.2 79.0 15.7 80.0 1.4 81.0 4.5 91.0 4.4 92.0 1.9 93.0 15.2 94.0 1.3 105.0 1.1 107.0 7.1 135.0 100.0 136.0 11.1
in CDCl3
4880 A,200 M,powder
