Product NameTERPIN MONOHYDRATE
CAS2451-01-6
Molecular FormulaC10H22O3
Molecular Weight190.28
InChIInChI=1S/C10H20O2.H2O/c1-9(2,11)8-4-6-10(3,12)7-5-8;/h8,11-12H,4-7H2,1-3H3;1H2
InChIKey JGKJMBOJWVAMIJ-UHFFFAOYSA-N
SmilesC(O)(C)(C)C1CCC(O)(C)CC1.O
Mass
MS-NW-9138 cis-1,8-terpin monohydrate C10H20O2 H2O (Mass of molecular ion: 172)
Source Temperature: 140 °C Sample Temperature: 80 °C Direct, 75 eV
17.0 1.8 18.0 11.2 27.0 1.9 29.0 2.9 31.0 3.2 39.0 2.0 41.0 6.3 43.0 37.2 45.0 1.5 53.0 1.5 54.0 7.0 55.0 13.6 56.0 1.7 57.0 1.9 58.0 7.4 59.0 51.9 60.0 1.7 66.0 1.0 67.0 11.6 68.0 15.1 69.0 9.6 71.0 15.6 72.0 1.0 77.0 15.4 79.0 1.8 81.0 100.0 82.0 7.1 83.0 4.6 84.0 8.7 85.0 1.3 93.0 5.0 94.0 1.8 95.0 11.6 96.0 99.2 97.0 10.1 107.0 1.4 108.0 7.3 111.0 4.7 121.0 3.6 125.0 3.1 126.0 3.8 136.0 4.3 137.0 4.6 139.0 20.0 140.0 2.0 154.0 5.4 155.0 1.3
in DMSO-d6
in DMSO-d6
KBr disc
nujol mull
4880 A,200 M,powder
TERPIN MONOHYDRATE(2451-01-6) Raman Atlas of Related Products
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