CID 5975

Cyanide

Structural Information

Molecular Formula
CN
SMILES
[C-]#N
InChI
InChI=1S/CN/c1-2/q-1
InChIKey
XFXPMWWXUTWYJX-UHFFFAOYSA-N
Compound name
cyanide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

13218
References

52202
Patents

26.003075 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 27.010351 98.9
[M+Na]+ 48.992293 109.5
[M-H]- 24.995799 99.1
[M+NH4]+ 44.036898 122.1
[M+K]+ 64.966233 110.3
[M+H-H2O]+ 9.000335 91.4
[M+HCOO]- 71.001276 120.2
[M+CH3COO]- 85.016926 167.0
[M+Na-2H]- 46.977741 107.4
[M]+ 26.002526 91.8
[M]- 26.003624 91.8
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