Product NameEINECS 215-962-9
CAS80656-14-0
Molecular FormulaC7H10O4
Molecular Weight158.1519
InChIInChI=1S/C7H10O4/c8-6(9)4-2-1-3-5(4)7(10)11/h4-5H,1-3H2,(H,8,9)(H,10,11)
InChIKey ASJCSAKCMTWGAH-UHFFFAOYSA-N
SmilesC1(C(O)=O)CCCC1C(O)=O
Mass
MS-KW-0673 trans-(+-)-1,2-cyclopentanedicarboxylic acid C7H10O4 (Mass of molecular ion: 158)
Source Temperature: 170 °C Sample Temperature: 140 °C Direct, 75 eV
17.0 1.1 18.0 5.8 27.0 7.4 28.0 3.4 29.0 5.1 31.0 1.2 38.0 1.4 39.0 14.4 40.0 4.2 41.0 23.2 42.0 6.2 43.0 6.7 44.0 1.2 45.0 8.5 47.0 1.1 53.0 3.0 55.0 21.5 56.0 1.6 57.0 3.1 59.0 1.3 60.0 5.0 65.0 4.7 66.0 6.2 67.0 100.0 68.0 34.9 69.0 4.8 71.0 1.9 73.0 8.1 83.0 6.3 84.0 2.9 85.0 1.2 86.0 11.5 87.0 1.0 94.0 2.2 95.0 25.0 96.0 2.7 97.0 8.6 99.0 30.3 100.0 1.8 101.0 4.2 111.0 1.2 112.0 80.9 113.0 10.3 114.0 6.5 117.0 3.1 122.0 2.8 124.0 1.5 140.0 24.8 141.0 3.9
KBr disc
nujol mull
EINECS 215-962-9(80656-14-0) IR2 Atlas of Related Products
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