Mol:
5981-09-9.mol by:chem960.com
ChemDraw08031019472D
…………
0 0 0 0 0 0 0 0 0 0 0 0
4.0790 7.0650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7193 6.2800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 7.0650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 8.6350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7193 9.4200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0790 8.6350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 9.4200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
7 2 1 0 0 0 0
5 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 2 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
14 9 1 0 0 0 0
12 15 1 0 0 0 0
8 16 1 0 0 0 0
16 17 2 0 0 0 0
17 18 1 0 0 0 0
18 19 2 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 16 1 0 0 0 0
19 22 1 0 0 0 0
M END
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三(4-氨基苯基)胺 MDL:
MFCD00778301
三(4-氨基苯基)胺 InChIKey:
SNLFYGIUTYKKOE-UHFFFAOYSA-N
三(4-氨基苯基)胺 Inchi:
1S/C18H18N4/c19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18/h1-12H,19-21H2
三(4-氨基苯基)胺 SMILES:
N(C1C([H])=C([H])C(=C([H])C=1[H])N([H])[H])(C1C([H])=C([H])C(=C([H])C=1[H])N([H])[H])C1C([H])=C([H])C(=C([H])C=1[H])N([H])[H]