Product Name8-AZAXANTHIN
CAS1468-26-4
Molecular FormulaC4H3N5O2
Molecular Weight153.1
InChIInChI=1S/C4H3N5O2/c10-3-1-2(8-9-7-1)5-4(11)6-3/h(H3,5,6,7,8,9,10,11)
InChIKey KVGVQTOQSNJTJI-UHFFFAOYSA-N
SmilesC1(=O)NC(=O)C2N=NNC=2N1
Mass
MS-NW-5321 8-azaxanthine C4H3N5O2 H2O (Mass of molecular ion: 153)
Source Temperature: 190 °C Sample Temperature: 140 °C Direct, 75 eV
12.0 1.3 13.0 1.7 16.0 1.3 17.0 4.1 18.0 12.7 24.0 1.1 25.0 1.3 26.0 2.0 27.0 22.0 28.0 25.1 29.0 18.1 30.0 1.3 38.0 6.1 39.0 3.4 40.0 1.5 41.0 4.6 42.0 4.0 43.0 13.9 44.0 10.9 52.0 4.5 53.0 84.6 54.0 40.0 55.0 4.7 56.0 1.1 67.0 11.2 68.0 1.9 69.0 6.1 70.0 7.9 82.0 7.1 83.0 1.8 97.0 1.3 110.0 100.0 111.0 5.2 125.0 11.0 127.0 1.2 153.0 93.7 154.0 6.3
KBr disc
nujol mull
8-AZAXANTHIN(1468-26-4) IR2 Atlas of Related Products
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