CID 75408

Methanediamine

Structural Information

Molecular Formula
CH6N2
SMILES
C(N)N
InChI
InChI=1S/CH6N2/c2-1-3/h1-3H2
InChIKey
RTWNYYOXLSILQN-UHFFFAOYSA-N
Compound name
methanediamine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

34
References

22778
Patents

46.053097 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 47.060373 104.4
[M+Na]+ 69.042315 111.9
[M-H]- 45.045821 104.3
[M+NH4]+ 64.086920 128.7
[M+K]+ 85.016255 112.2
[M+H-H2O]+ 29.050357 100.1
[M+HCOO]- 91.051298 130.5
[M+CH3COO]- 105.06695 160.2
[M+Na-2H]- 67.027763 112.4
[M]+ 46.052548 100.0
[M]- 46.053646 100.0
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