CID 92708

57210-34-1

Structural Information

Molecular Formula
C19H26N5O2
SMILES
CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C19H26N5O2/c1-5-22(14-15-24(2,3)4)18-10-6-16(7-11-18)20-21-17-8-12-19(13-9-17)23(25)26/h6-13H,5,14-15H2,1-4H3/q+1
InChIKey
MFYFEVIZGWMADM-UHFFFAOYSA-N
Compound name
2-[N-ethyl-4-[(4-nitrophenyl)diazenyl]anilino]ethyl-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

356.20865 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.21593 183.7
[M+Na]+ 379.19787 186.3
[M-H]- 355.20137 194.8
[M+NH4]+ 374.24247 196.3
[M+K]+ 395.17181 175.8
[M+H-H2O]+ 339.20591 180.4
[M+HCOO]- 401.20685 213.4
[M+CH3COO]- 415.22250 223.3
[M+Na-2H]- 377.18332 194.2
[M]+ 356.20810 184.5
[M]- 356.20920 184.5
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

patents stripe