CID 89901

Guanidine, n-cyano-n'-(methoxymethyl)-

Structural Information

Molecular Formula
C4H8N4O
SMILES
COCN=C(N)NC#N
InChI
InChI=1S/C4H8N4O/c1-9-3-8-4(6)7-2-5/h3H2,1H3,(H3,6,7,8)
InChIKey
RSKNWCGKYIHOGS-UHFFFAOYSA-N
Compound name
1-cyano-2-(methoxymethyl)guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

128.06981 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.077086 125.9
[M+Na]+ 151.059028 133.3
[M-H]- 127.062534 127.4
[M+NH4]+ 146.103633 145.1
[M+K]+ 167.032968 134.6
[M+H-H2O]+ 111.067070 113.4
[M+HCOO]- 173.068011 149.4
[M+CH3COO]- 187.083661 192.2
[M+Na-2H]- 149.044476 132.2
[M]+ 128.06926142 119.7
[M]- 128.07035858 119.7
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