CID 20531563

2,3-diaminopropanenitrile dihydrochloride

Structural Information

Molecular Formula
C3H7N3
SMILES
C(C(C#N)N)N
InChI
InChI=1S/C3H7N3/c4-1-3(6)2-5/h3H,1,4,6H2
InChIKey
AHHLOPQSUMHMJL-UHFFFAOYSA-N
Compound name
2,3-diaminopropanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

85.063995 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 86.071271 119.5
[M+Na]+ 108.05321 127.6
[M+NH4]+ 103.09782 124.0
[M+K]+ 124.02715 120.6
[M-H]- 84.056719 112.8
[M+Na-2H]- 106.03866 120.9
[M]+ 85.063446 117.6
[M]- 85.064544 117.6
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