CID 82770

(4-ethylphenyl)(4-methoxyphenyl)diazene oxide

Structural Information

Molecular Formula
C15H16N2O2
SMILES
CCC1=CC=C(C=C1)[N+](=NC2=CC=C(C=C2)OC)[O-]
InChI
InChI=1S/C15H16N2O2/c1-3-12-4-8-14(9-5-12)17(18)16-13-6-10-15(19-2)11-7-13/h4-11H,3H2,1-2H3
InChIKey
MCKGGSQKOSKNHA-UHFFFAOYSA-N
Compound name
(4-ethylphenyl)-(4-methoxyphenyl)imino-oxidoazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

256.1212 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.12848 158.0
[M+Na]+ 279.11042 173.4
[M+NH4]+ 274.15502 167.2
[M+K]+ 295.08436 167.3
[M-H]- 255.11392 165.4
[M+Na-2H]- 277.09587 168.1
[M]+ 256.12065 162.4
[M]- 256.12175 162.4
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