Mol:
32503-27-8.mol by:chem960.com
ChemDraw08031019472D
…………
0650 3.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6350 3.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4200 1.9907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.6533 4.7100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
13.0833 4.7100 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
13.0833 6.2800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
13.0833 3.1400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
11.5133 4.7100 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
5 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
5 10 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
5 14 1 0 0 0 0
14 15 1 0 0 0 0
15 16 1 0 0 0 0
16 17 1 0 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
19 21 2 0 0 0 0
19 22 1 0 0 0 0
M CHG 1 5 1
M CHG 1 22 -1
M END
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四丁基硫酸氢铵 MDL:
MFCD00011637
四丁基硫酸氢铵 InChIKey:
SHFJWMWCIHQNCP-UHFFFAOYSA-M
四丁基硫酸氢铵 Inchi:
1S/C16H36N.H2O4S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-5(2,3)4/h5-16H2,1-4H3;(H2,1,2,3,4)/q+1;/p-1
四丁基硫酸氢铵 SMILES:
CCCC[N+](CCCC)(CCCC)CCCC.[O-]S(=O)(O)=O
四丁基硫酸氢铵 BRN:
3599663