Product NameSynephrine
CAS94-07-5
Molecular FormulaC9H13NO2
Molecular Weight167.21
InChIInChI=1/C9H13NO2/c1-10-6-9(12)7-2-4-8(11)5-3-7/h2-5,9-12H,6H2,1H3/t9-/s3
InChIKey YRCWQPVGYLYSOX-DJEYLCQNNA-N
SmilesC1(=CC=C(O)C=C1)[C@@H](O)CNC |&1:7,r|
Mass
MS-NW-2001 synephrine C9H13NO2 (Mass of molecular ion: 167)
Source Temperature: 220 °C Sample Temperature: 140 °C Direct, 75 eV
15.0 4.0 17.0 2.4 18.0 12.1 27.0 2.5 28.0 3.3 30.0 2.2 38.0 1.0 39.0 5.6 41.0 2.2 42.0 68.9 43.0 4.0 44.0 100.0 45.0 8.1 46.0 4.7 50.0 1.7 51.0 4.2 52.0 1.8 53.0 1.9 55.0 1.6 62.0 1.0 63.0 2.4 65.0 3.8 77.0 10.8 78.0 2.8 79.0 2.6 80.0 1.5 89.0 1.2 90.0 1.7 91.0 2.8 93.0 1.0 94.0 1.4 95.0 3.5 106.0 1.7 107.0 25.3 108.0 63.2 109.0 5.0 116.0 1.2 117.0 1.0 118.0 1.5 119.0 1.3 120.0 3.4 121.0 2.5 122.0 1.0 123.0 4.2 132.0 1.6 133.0 2.6 134.0 2.0 146.0 2.8 147.0 5.6 148.0 6.5 149.0 30.7 150.0 3.3
KBr disc
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