Mol:
13924-99-7.mol by:chem960.com
ChemDraw08031019472D
…………
3.9250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 1.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 2.3550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 7 1 0 0 0 0
7 2 1 0 0 0 0
6 8 1 0 0 0 0
8 9 2 0 0 0 0
8 10 1 0 0 0 0
M END
如需查看或获取完整mol文件,请关注官方微信公众号(微信搜一搜:Chem960),回复CAS号+“mol”(如回复:98-98-6 mol)免费获取。
6-氧代-1,6-二氢吡嗪-2-甲酸 MDL: MFCD10697776
6-氧代-1,6-二氢吡嗪-2-甲酸 InChIKey: LHXIGTYJDLGWRO-UHFFFAOYSA-N
6-氧代-1,6-二氢吡嗪-2-甲酸 Inchi: 1S/C5H4N2O3/c8-4-2-6-1-3(7-4)5(9)10/h1-2H,(H,7,8)(H,9,10)
6-氧代-1,6-二氢吡嗪-2-甲酸 SMILES: O([H])C(C1=C([H])N=C([H])C(N1[H])=O)=O