CID 16683514

79422-25-6

Structural Information

Molecular Formula
C5H9GaN2
SMILES
C[Ga](C)N1C=CC=N1
InChI
InChI=1S/C3H3N2.2CH3.Ga/c1-2-4-5-3-1;;;/h1-3H;2*1H3;/q-1;;;+1
InChIKey
OCMNILXULTZLFQ-UHFFFAOYSA-N
Compound name
dimethyl(pyrazol-1-yl)gallane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.00215 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.00943 131.6
[M+Na]+ 188.99137 139.6
[M-H]- 164.99487 132.2
[M+NH4]+ 184.03597 153.0
[M+K]+ 204.96531 138.9
[M+H-H2O]+ 148.99941 124.3
[M+HCOO]- 211.00035 153.7
[M+CH3COO]- 225.01600 170.6
[M+Na-2H]- 186.97682 136.7
[M]+ 166.00160 131.5
[M]- 166.00270 131.5
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

No patent data available for this compound.