barium(+2) cation; 4-tert-butylbenzoate
Molecular Formula:
C
22
H
26
BaO
4
InChI:
InChI=1/2C11H14O2.Ba/c2*1-11(2,3)9-6-4-8(5-7-9)10(12)13;/h2*4-7H,1-3H3,(H,12,13);/q;;+2/p-2/f2C11H13O2.Ba/q2*-1;m
InChIKey:
InChIKey=TVGPWOZHNCQATG-GXSPTCPHCR
SMILES:
CC(C)(C)C1=CC=C(C=C1)C(=O)[O-].CC(C)(C)C1=CC=C(C=C1)C(=O)[O-].[Ba+2]
Names:
barium(+2) cation; 4-tert-butylbenzoate
Registries:
PubChem CID 82446
PubChem ID 10219399