Molecular FormulaC13H19BrO2
Molecular Weight287.19276
InChIInChI=1S/C13H19BrO2/c1-11-3-9-4-12(6-11,10(15)16-2)8-13(14,5-9)7-11/h9H,3-8H2,1-2H3
InChIKey YWJNXVRXYMATJJ-UHFFFAOYSA-N
SmilesC12(C(OC)=O)CC3(C)CC(CC(Br)(C3)C1)C2
Mass
MS-NW-6691 methyl 3-bromo-1-adamantaneacetate C13H19BrO2 (Mass of molecular ion: 286)
Source Temperature: 240 °C Sample Temperature: 190 °C Reservoir, 75 eV
15.0 2.6 27.0 2.4 29.0 1.9 39.0 4.9 41.0 6.8 43.0 1.2 51.0 1.4 53.0 3.3 55.0 4.6 59.0 2.3 65.0 2.9 66.0 1.0 67.0 2.7 69.0 1.1 73.0 1.6 74.0 2.1 75.0 1.2 77.0 6.4 78.0 2.1 79.0 7.0 80.0 1.0 81.0 1.7 91.0 29.5 92.0 7.3 93.0 10.7 94.0 1.0 104.0 1.1 105.0 12.0 106.0 1.8 107.0 1.6 109.0 1.1 117.0 1.4 119.0 4.6 121.0 1.5 131.0 2.8 133.0 31.5 134.0 4.4 147.0 15.5 148.0 2.3 151.0 2.0 165.0 1.3 175.0 12.1 176.0 1.6 181.0 1.0 207.0 100.0 208.0 14.6 209.0 1.4 213.0 2.0 215.0 2.0 255.0 2.3 257.0 2.2
in CDCl3
KBr disc
liquid film
nujol mull
4880 A,200 M,powder
methyl 3-bromo-5-methyltricyclo[3.3.1.13,7]decane-1-carboxylate (14575-01-0) 13C NMR Atlas of Related Products
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