CID 9587910

N-(imino((5-methyl-3-isoxazolyl)amino)methyl)-4-methyl-1-piperazinecarboximidamide

Structural Information

Molecular Formula
C11H19N7O
SMILES
CC1=CC(=NO1)N=C(N)/N=C(\N)/N2CCN(CC2)C
InChI
InChI=1S/C11H19N7O/c1-8-7-9(16-19-8)14-10(12)15-11(13)18-5-3-17(2)4-6-18/h7H,3-6H2,1-2H3,(H4,12,13,14,15,16)
InChIKey
IKJYEIHTGRZMNP-UHFFFAOYSA-N
Compound name
4-methyl-N'-[N'-(5-methyl-1,2-oxazol-3-yl)carbamimidoyl]piperazine-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.1651 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.17238 162.1
[M+Na]+ 288.15432 168.5
[M+NH4]+ 283.19892 167.0
[M+K]+ 304.12826 167.5
[M-H]- 264.15782 165.8
[M+Na-2H]- 286.13977 165.3
[M]+ 265.16455 163.2
[M]- 265.16565 163.2
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.