CID 35602

10300-69-3

Structural Information

Molecular Formula
C2H5ClN2
SMILES
C(C(=N)N)Cl
InChI
InChI=1S/C2H5ClN2/c3-1-2(4)5/h1H2,(H3,4,5)
InChIKey
NJAHGEUFOYIGKR-UHFFFAOYSA-N
Compound name
2-chloroethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

469
Patents

92.01413 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 93.021406 114.9
[M+Na]+ 115.00335 122.8
[M-H]- 91.006854 115.1
[M+NH4]+ 110.04795 138.3
[M+K]+ 130.97729 120.8
[M+H-H2O]+ 75.011390 111.5
[M+HCOO]- 137.01233 135.9
[M+CH3COO]- 151.02798 167.7
[M+Na-2H]- 112.98880 121.5
[M]+ 92.013581 112.3
[M]- 92.014679 112.3
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