Product NameN-Acetyl-DL-tryptophan
CAS87-32-1
Molecular FormulaC13H14N2O3
Molecular Weight246.26
InChIInChI=1S/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/t12-/m0/s1
InChIKey DZTHIGRZJZPRDV-LBPRGKRZSA-N
SmilesC(O)(=O)[C@H](CC1C2=C(C=CC=C2)NC=1)NC(C)=O
Mass
MS-NW-2139 N(alpha)-acetyl-DL-tryptophan C13H14N2O3 (Mass of molecular ion: 246)
Source Temperature: 200 °C Sample Temperature: 240 °C Direct, 75 eV
15.0 1.6 17.0 1.3 18.0 6.7 27.0 1.0 28.0 3.5 39.0 1.6 41.0 2.1 43.0 8.2 44.0 3.0 50.0 1.3 51.0 2.3 63.0 1.8 74.0 1.1 75.0 1.4 76.0 1.7 77.0 5.9 89.0 1.3 90.0 1.0 101.0 1.0 102.0 4.1 103.0 4.9 115.0 3.6 116.0 1.1 117.0 2.8 128.0 2.3 129.0 7.6 130.0 100.0 131.0 10.9 132.0 1.0 141.0 1.3 142.0 1.9 143.0 6.3 154.0 1.3 155.0 1.3 156.0 1.7 157.0 3.4 158.0 5.0 159.0 1.8 169.0 1.2 181.0 1.8 182.0 7.5 183.0 1.8 187.0 9.0 188.0 1.1 200.0 4.2 228.0 6.2 246.0 3.2
KBr disc
nujol mull
N-Acetyl-DL-tryptophan(87-32-1) 1H NMR Atlas of Related Products