CID 89633

Bis(2-aminoethyl)borate

Structural Information

Molecular Formula
C4H13BN2O3
SMILES
B(O)(OCCN)OCCN
InChI
InChI=1S/C4H13BN2O3/c6-1-3-9-5(8)10-4-2-7/h8H,1-4,6-7H2
InChIKey
UKSJHEHERZWQRA-UHFFFAOYSA-N
Compound name
bis(2-aminoethoxy)borinic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

14
Patents

148.10193 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.10921 129.7
[M+Na]+ 171.09115 134.9
[M-H]- 147.09465 127.5
[M+NH4]+ 166.13575 149.1
[M+K]+ 187.06509 135.1
[M+H-H2O]+ 131.09919 124.1
[M+HCOO]- 193.10013 152.9
[M+CH3COO]- 207.11578 176.4
[M+Na-2H]- 169.07660 134.0
[M]+ 148.10138 128.6
[M]- 148.10248 128.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe