Mol:
15100-75-1.mol by:chem960.com
ChemDraw08031019472D
…………
0 0 0 0 0 0 0 0
2.7193 2.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7193 0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 2.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 0 0 0 0
2 4 1 0 0 0 0
2 5 1 0 0 0 0
2 6 1 0 0 0 0
6 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 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 15 1 0 0 0 0
15 16 2 0 0 0 0
16 11 1 0 0 0 0
7 17 2 0 0 0 0
M END
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L-苯丙氨酸叔丁酯盐酸盐 MDL: MFCD00038894
L-苯丙氨酸叔丁酯盐酸盐 InChIKey: FDMCEXDXULPJPG-MERQFXBCSA-N
L-苯丙氨酸叔丁酯盐酸盐 Inchi: 1S/C13H19NO2.ClH/c1-13(2,3)16-12(15)11(14)9-10-7-5-4-6-8-10;/h4-8,11H,9,14H2,1-3H3;1H/t11-;/m0./s1
L-苯丙氨酸叔丁酯盐酸盐 SMILES: Cl[H].O(C([C@]([H])(C([H])([H])C1C([H])=C([H])C([H])=C([H])C=1[H])N([H])[H])=O)C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H]
L-苯丙氨酸叔丁酯盐酸盐 BRN: 4723424