CID 177595

Tetrahydroxyboranuide

Structural Information

Molecular Formula
BH4O4
SMILES
[B-](O)(O)(O)O
InChI
InChI=1S/BH4O4/c2-1(3,4)5/h2-5H/q-1
InChIKey
KCFLOKKYWBPKFN-UHFFFAOYSA-N
Compound name
tetrahydroxyboranuide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

428
Patents

79.02026 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 80.027536 108.7
[M+Na]+ 102.00948 116.3
[M-H]- 78.012984 102.5
[M+NH4]+ 97.054083 129.4
[M+K]+ 117.98342 115.7
[M+H-H2O]+ 62.017520 108.4
[M+HCOO]- 124.01846 126.8
[M+CH3COO]- 138.03411 145.7
[M+Na-2H]- 99.994926 116.2
[M]+ 79.019711 103.3
[M]- 79.020809 103.3
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