CID 203064

13736-88-4

Structural Information

Molecular Formula
C15H25N3O
SMILES
CCCCCCCCOC1=C(C=C(C=C1)N)C(=N)N
InChI
InChI=1S/C15H25N3O/c1-2-3-4-5-6-7-10-19-14-9-8-12(16)11-13(14)15(17)18/h8-9,11H,2-7,10,16H2,1H3,(H3,17,18)
InChIKey
LBRYDJSLUJELGU-UHFFFAOYSA-N
Compound name
5-amino-2-octoxybenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.19977 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.20705 165.5
[M+Na]+ 286.18899 169.6
[M-H]- 262.19249 167.5
[M+NH4]+ 281.23359 180.9
[M+K]+ 302.16293 165.9
[M+H-H2O]+ 246.19703 157.8
[M+HCOO]- 308.19797 189.2
[M+CH3COO]- 322.21362 207.6
[M+Na-2H]- 284.17444 166.5
[M]+ 263.19922 164.1
[M]- 263.20032 164.1
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.