CID 218948

Guanidine, 1-ethoxyformimidoyl-

Structural Information

Molecular Formula

C₄H₁₀N₄O

SMILES

CCOC(=N)N=C(N)N

InChI

InChI=1S/C4H10N4O/c1-2-9-4(7)8-3(5)6/h2H2,1H3,(H5,5,6,7,8)

InChIKey

WKEZVPCBTGWEIF-UHFFFAOYSA-N

Compound name

ethyl N-(diaminomethylidene)carbamimidate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 3
Patents: 130.08546 Da
Monoisotopic Mass: -0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	131.09274	127.0
[M+Na]+	153.07468	132.3
[M-H]-	129.07818	128.0
[M+NH4]+	148.11928	147.7
[M+K]+	169.04862	133.0
[M+H-H2O]+	113.08272	120.7
[M+HCOO]-	175.08366	154.2
[M+CH3COO]-	189.09931	182.2
[M+Na-2H]-	151.06013	131.6
[M]+	130.08491	122.5
[M]-	130.08601	122.5

Literature stripe

literature stripe

Patent stripe

patents stripe