CID 160435

Carbodiimide

Structural Information

Molecular Formula
CH2N2
SMILES
C(=N)=N
InChI
InChI=1S/CH2N2/c2-1-3/h2-3H
InChIKey
VPKDCDLSJZCGKE-UHFFFAOYSA-N
Compound name
methanediimine
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

2174
References

59227
Patents

42.021797 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 43.029073 101.0
[M+Na]+ 65.011015 109.1
[M-H]- 41.014521 102.1
[M+NH4]+ 60.055620 125.9
[M+K]+ 80.984955 108.9
[M+H-H2O]+ 25.019057 96.9
[M+HCOO]- 87.019998 128.7
[M+CH3COO]- 101.03565 159.6
[M+Na-2H]- 62.996463 111.2
[M]+ 42.021248 97.3
[M]- 42.022346 97.3
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

No patent data available for this compound.