S-Benzyl-L-cysteine(3054-01-1) IR2
Product NameS-Benzyl-L-cysteine
CAS3054-01-1
Molecular FormulaC10H13NO2S
Molecular Weight211.28
InChIInChI=1S/C10H13NO2S/c11-9(10(12)13)7-14-6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/t9-/m0/s1
InChIKey GHBAYRBVXCRIHT-VIFPVBQESA-N
SmilesC(O)(=O)[C@H](CSCC1=CC=CC=C1)N
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MassMS-NW-2491 S-benzyl-L-cysteine C10H13NO2S (Mass of molecular ion: 211)
Source Temperature: 190 °C Sample Temperature: 140 °C Direct, 75 eV
17.0 1.0 18.0 4.8 28.0 4.9 30.0 2.4 39.0 3.4 41.0 1.8 42.0 4.7 43.0 5.5 44.0 2.8 45.0 5.0 46.0 1.4 51.0 2.1 63.0 1.9 65.0 8.1 71.0 1.0 74.0 12.1 77.0 1.8 87.0 1.2 89.0 7.4 90.0 1.5 91.0 100.0 92.0 8.9 121.0 1.6 122.0 6.1 123.0 1.7 124.0 4.3 137.0 15.2 138.0 15.8 139.0 2.2 166.0 2.4 211.0 5.1
KBr disc
nujol mull
