Basic Information |
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Product Name: | 2,6-DIHYDROXY-7-METHYLPURINE-2,4,5,6-13C4, 1,3-15N2 |
CAS: | 552-62-5 |
English Synonyms: | 7-METHYLXANTHINE-2,4,5,6-13C4, 1,3,9-15N3 ; 7-METHYLXANTHINE-[13C4,15N3] ; 7-METHYLXANTHINE-2,4,5,6-13C4, 1,3-15N2 ; 2,6-DIHYDROXY-7-METHYLPURINE-2,4,5,6-13C4, 1,3-15N2 |
MDL Number.: | MFCD11656102 |
H bond acceptor: | 6 |
H bond donor: | 2 |
Smile: | Cn1c[15n][13c]2[13c]1[13c](=O)[15nH][13c](=O)[15nH]2 |
InChi: | InChI=1S/C6H6N4O2/c1-10-2-7-4-3(10)5(11)9-6(12)8-4/h2H,1H3,(H2,8,9,11,12)/i3+1,4+1,5+1,6+1,7+1,8+1,9+1 |
InChiKey: | InChIKey=PFWLFWPASULGAN-JVYICBGUSA-N |
Property |
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Melting Point: | =>300 DEG C |
Comments: | ASSAY METHOD: CP MASS SHIFT: M+7 STORAGE TEMPERATURE: -20 DEG C WGK: 2 |
Information: | ISOTOPIC PURITY: 98 ATOM% 15N (BASED ON 15N2) ISOTOPIC PURITY: 99 ATOM% 13C MW: 172.02 BY ATOM% CALCULATION PARTIAL 15N LABELING AT N9 |
Safety information |
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WGK Germany: | 2 |
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