CID 9243

Borane, tris(2-aminoethyl)-

Structural Information

Molecular Formula
C6H18BN3O3
SMILES
B(OCCN)(OCCN)OCCN
InChI
InChI=1S/C6H18BN3O3/c8-1-4-11-7(12-5-2-9)13-6-3-10/h1-6,8-10H2
InChIKey
LIFLTRKTCZIBEB-UHFFFAOYSA-N
Compound name
tris(2-aminoethyl) borate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

105
Patents

191.14412 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.15140 140.5
[M+Na]+ 214.13334 144.3
[M-H]- 190.13684 138.7
[M+NH4]+ 209.17794 158.1
[M+K]+ 230.10728 144.7
[M+H-H2O]+ 174.14138 133.6
[M+HCOO]- 236.14232 164.9
[M+CH3COO]- 250.15797 189.7
[M+Na-2H]- 212.11879 143.5
[M]+ 191.14357 140.2
[M]- 191.14467 140.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe