ALPHA-METHYL-DL-SERINE(5424-29-3) IR1
Product NameALPHA-METHYL-DL-SERINE
CAS5424-29-3
Molecular FormulaC4H9NO3
Molecular Weight119.12
InChIInChI=1S/C4H9NO3/c1-4(5,2-6)3(7)8/h6H,2,5H2,1H3,(H,7,8)/t4-/m0/s1
InChIKey CDUUKBXTEOFITR-BYPYZUCNSA-N
SmilesC(O)(=O)[C@](C)(CO)N
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MassMS-NW-6928 2-methyl-DL-serine C4H9NO3 (Mass of molecular ion: 119)
Source Temperature: 220 °C Sample Temperature: 130 °C Direct, 75 eV
15.0 8.4 18.0 10.3 26.0 1.6 27.0 5.8 28.0 18.7 29.0 8.9 30.0 6.2 31.0 7.6 38.0 1.0 39.0 2.7 40.0 3.3 41.0 8.1 42.0 100.0 43.0 13.6 44.0 4.8 45.0 4.0 54.0 1.2 55.0 1.7 56.0 19.7 57.0 10.3 58.0 3.0 59.0 1.2 60.0 1.7 71.0 2.0 72.0 1.4 74.0 39.6 75.0 1.6 88.0 45.5 89.0 4.7
90 MHz in D2O
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1H NMR 89.56 MHz C4 H9 N O3 saturated in D2O 2-methyl-DL-serine 
Assign. Shift(ppm)
A *1 3.900 B *1 3.687 C 1.431 SOLVENT PEAK REMOVED
Hz ppm Int.358.00 3.998 95 345.94 3.863 251 333.63 3.726 247 321.56 3.591 95 128.19 1.432 1000
KBr disc
nujol mull
