Product Name((4-(4-amidinophenoxy)butanoyl)aspartyl)valine
CAS147865-49-4
Molecular FormulaC20H28N4O7
Molecular Weight436.46
InChI
InChIKey
Smiles
Mass
MS2001-00786WA N-(4-(4-(amino(imino)methyl)phenoxy)butanoyl)-L-alpha-aspartyl-L-valine C20H28N4O7 (Mass of molecular ion: 436)
Source Temperature: 230 °C Sample Temperature: 310 °C Direct, 70 eV
27.0 2.0 28.0 1.7 39.0 3.0 41.0 9.5 42.0 2.6 43.0 6.5 44.0 1.7 55.0 5.3 56.0 1.5 63.0 1.8 64.0 2.2 65.0 1.5 68.0 1.1 69.0 9.3 70.0 5.0 72.0 3.2 75.0 1.2 82.0 1.6 83.0 1.1 84.0 1.2 85.0 1.6 86.0 7.5 87.0 1.2 90.0 2.5 91.0 2.6 96.0 1.0 98.0 3.6 100.0 1.2 102.0 7.7 103.0 1.3 104.0 1.5 110.0 1.8 111.0 2.0 112.0 10.2 113.0 1.7 114.0 1.1 115.0 1.2 119.0 10.8 120.0 7.4 124.0 1.4 125.0 1.2 126.0 1.3 132.0 6.1 136.0 3.5 138.0 1.7 140.0 1.1 141.0 2.4 151.0 1.0 152.0 3.0 153.0 1.9 160.0 1.0 167.0 2.1 168.0 1.4 169.0 1.8 183.0 9.9 184.0 1.1 188.0 5.6 195.0 2.8 209.0 2.6 210.0 13.4 211.0 2.0 212.0 1.0 223.0 1.1 237.0 39.5 238.0 9.8 239.0 7.9 240.0 1.6 256.0 2.0 257.0 1.0 264.0 1.1 282.0 2.1 283.0 100.0 284.0 15.1 285.0 2.3 357.0 1.0
in DMSO-d6
in DMSO-d6
KBr disk
Nujol
((4-(4-amidinophenoxy)butanoyl)aspartyl)valine(147865-49-4) 13C NMR Atlas of Related Products
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