CID 71655

Moroxydine

Structural Information

Molecular Formula

C₆H₁₃N₅O

SMILES

C1COCCN1C(=N)N=C(N)N

InChI

InChI=1S/C6H13N5O/c7-5(8)10-6(9)11-1-3-12-4-2-11/h1-4H2,(H5,7,8,9,10)

InChIKey

KJHOZAZQWVKILO-UHFFFAOYSA-N

Compound name

N-(diaminomethylidene)morpholine-4-carboximidamide

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 81
References: 10816
Patents: 171.11201 Da
Monoisotopic Mass: -1.6
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]+	172.119286	138.9
[M+Na]+	194.101228	141.9
[M-H]-	170.104734	141.4
[M+NH4]+	189.145833	154.9
[M+K]+	210.075168	142.5
[M+H-H2O]+	154.109270	130.7
[M+HCOO]-	216.110211	160.7
[M+CH3COO]-	230.125861	187.6
[M+Na-2H]-	192.086676	143.6
[M]+	171.11146142	129.9
[M]-	171.11255858	129.9

Literature stripe

literature stripe

Patent stripe

patents stripe