CID 71300479

Einecs 304-036-0

Structural Information

Molecular Formula
C17H24N5O
SMILES
CCN(CC)C1=CC(=C(C=C1)N=NC2=[N+](N=C(C=C2)OC)C)C
InChI
InChI=1S/C17H24N5O/c1-6-22(7-2)14-8-9-15(13(3)12-14)18-19-16-10-11-17(23-5)20-21(16)4/h8-12H,6-7H2,1-5H3/q+1
InChIKey
INEBZINYOCWLQZ-UHFFFAOYSA-N
Compound name
N,N-diethyl-4-[(6-methoxy-2-methylpyridazin-2-ium-3-yl)diazenyl]-3-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.1981 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.20538 174.4
[M+Na]+ 337.18732 189.8
[M+NH4]+ 332.23192 182.5
[M+K]+ 353.16126 182.8
[M-H]- 313.19082 182.0
[M+Na-2H]- 335.17277 184.5
[M]+ 314.19755 179.1
[M]- 314.19865 179.1
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.