Product NameMURAMIC ACID
CAS1114-41-6
Molecular FormulaC9H17NO7
Molecular Weight251.23
InChIInChI=1S/C9H17NO7/c1-3(8(13)14)16-7-5(10)9(15)17-4(2-11)6(7)12/h3-7,9,11-12,15H,2,10H2,1H3,(H,13,14)/t3?,4-,5-,6-,7-,9+/m1/s1
InChIKey MSFSPUZXLOGKHJ-KDBDHQKJSA-N
SmilesC(O)(=O)C(O[C@@H]1[C@@H](N)[C@@H](O)O[C@H](CO)[C@H]1O)C
Mass
MS-NW-6690 (+)-muramic acid C9H17NO7 (Mass of molecular ion: 251)
Source Temperature: 200 °C Sample Temperature: 180 °C Direct, 75 eV
14.0 2.1 15.0 6.0 16.0 1.7 17.0 29.3 18.0 77.6 19.0 13.4 25.0 1.7 26.0 3.9 27.0 19.2 28.0 6.3 29.0 24.4 30.0 2.3 31.0 1.9 41.0 1.5 42.0 3.5 43.0 15.8 44.0 3.4 45.0 100.0 46.0 3.2 47.0 1.1 55.0 2.9 56.0 2.5 57.0 1.5 70.0 1.1 72.0 2.0 113.0 2.6 114.0 1.1 144.0 2.1
KBr disc
MURAMIC ACID(1114-41-6) MS Atlas of Related Products
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