CID 5017583

Ethyl 4-(phenylazo)phenyl carbonate

Structural Information

Molecular Formula
C15H14N2O3
SMILES
CCOC(=O)OC1=CC=C(C=C1)N=NC2=CC=CC=C2
InChI
InChI=1S/C15H14N2O3/c1-2-19-15(18)20-14-10-8-13(9-11-14)17-16-12-6-4-3-5-7-12/h3-11H,2H2,1H3
InChIKey
CJGURVSMTVAHLJ-UHFFFAOYSA-N
Compound name
ethyl (4-phenyldiazenylphenyl) carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.10043 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.10771 159.9
[M+Na]+ 293.08965 166.4
[M-H]- 269.09315 169.3
[M+NH4]+ 288.13425 176.6
[M+K]+ 309.06359 165.0
[M+H-H2O]+ 253.09769 150.8
[M+HCOO]- 315.09863 189.1
[M+CH3COO]- 329.11428 204.5
[M+Na-2H]- 291.07510 167.2
[M]+ 270.09988 164.0
[M]- 270.10098 164.0
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.