CID 15277

1562-94-3

Structural Information

Molecular Formula
C14H14N2O3
SMILES
COC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OC)[O-]
InChI
InChI=1S/C14H14N2O3/c1-18-13-7-3-11(4-8-13)15-16(17)12-5-9-14(19-2)10-6-12/h3-10H,1-2H3
InChIKey
KAEZRSFWWCTVNP-UHFFFAOYSA-N
Compound name
(4-methoxyphenyl)-(4-methoxyphenyl)imino-oxidoazanium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

617
Patents

258.10043 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.10771 156.9
[M+Na]+ 281.08965 163.2
[M-H]- 257.09315 165.1
[M+NH4]+ 276.13425 173.1
[M+K]+ 297.06359 157.1
[M+H-H2O]+ 241.09769 153.1
[M+HCOO]- 303.09863 185.0
[M+CH3COO]- 317.11428 194.7
[M+Na-2H]- 279.07510 165.2
[M]+ 258.09988 158.0
[M]- 258.10098 158.0
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.