CID 123487

N'-cyano-n,n-dimethylmethanimidamide

Structural Information

Molecular Formula
C4H7N3
SMILES
CN(C)C=NC#N
InChI
InChI=1S/C4H7N3/c1-7(2)4-6-3-5/h4H,1-2H3
InChIKey
QFHAGCRNENPASY-UHFFFAOYSA-N
Compound name
N'-cyano-N,N-dimethylmethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

97.063995 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 98.071271 117.6
[M+Na]+ 120.05321 126.3
[M-H]- 96.056719 121.1
[M+NH4]+ 115.09782 139.3
[M+K]+ 136.02715 128.1
[M+H-H2O]+ 80.061255 105.7
[M+HCOO]- 142.06220 142.1
[M+CH3COO]- 156.07785 189.5
[M+Na-2H]- 118.03866 125.5
[M]+ 97.063446 113.8
[M]- 97.064544 113.8
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