CID 93976

Lithium tetrakis(1-pyrryl)borate

Structural Information

Molecular Formula
C16H16BN4
SMILES
[B-](N1C=CC=C1)(N2C=CC=C2)(N3C=CC=C3)N4C=CC=C4
InChI
InChI=1S/C16H16BN4/c1-2-10-18(9-1)17(19-11-3-4-12-19,20-13-5-6-14-20)21-15-7-8-16-21/h1-16H/q-1
InChIKey
UVNBFKPKZQUUHS-UHFFFAOYSA-N
Compound name
tetra(pyrrol-1-yl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

275.1468 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.15408 155.2
[M+Na]+ 298.13602 163.5
[M-H]- 274.13952 163.9
[M+NH4]+ 293.18062 171.4
[M+K]+ 314.10996 160.6
[M+H-H2O]+ 258.14406 147.6
[M+HCOO]- 320.14500 179.5
[M+CH3COO]- 334.16065 167.8
[M+Na-2H]- 296.12147 157.1
[M]+ 275.14625 155.3
[M]- 275.14735 155.3
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