CID 6328336

Ammonium boranecarboxylate

Structural Information

Molecular Formula

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: 4
References: 534
Patents: 56.006958 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[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

Literature stripe

literature stripe

Patent stripe

patents stripe