CID 6328336

Ammonium boranecarboxylate

Structural Information

Molecular Formula
CHBO2
SMILES
[B]C(=O)O
InChI
InChI=1S/CHBO2/c2-1(3)4/h(H,3,4)
InChIKey
KUVACXWWIKEMLH-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

544
Patents

56.006958 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 57.014234 103.4
[M+Na]+ 78.996176 112.0
[M-H]- 54.999682 103.1
[M+NH4]+ 74.040781 127.8
[M+K]+ 94.970116 112.9
[M+H-H2O]+ 39.004218 100.1
[M+HCOO]- 101.00516 126.8
[M+CH3COO]- 115.02081 155.5
[M+Na-2H]- 76.981624 111.2
[M]+ 56.006409 102.8
[M]- 56.007507 102.8
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