CID 3058953

Brn 2743535

Structural Information

Molecular Formula
C19H14BrNO
SMILES
C1=CC=C(C=C1)C(=NC2=CC=CC=C2)OC3=CC=C(C=C3)Br
InChI
InChI=1S/C19H14BrNO/c20-16-11-13-18(14-12-16)22-19(15-7-3-1-4-8-15)21-17-9-5-2-6-10-17/h1-14H
InChIKey
GZNSWOXUVBQTDY-UHFFFAOYSA-N
Compound name
(4-bromophenyl) N-phenylbenzenecarboximidate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.02588 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.03316 175.1
[M+Na]+ 374.01510 183.8
[M-H]- 350.01860 187.5
[M+NH4]+ 369.05970 191.3
[M+K]+ 389.98904 171.8
[M+H-H2O]+ 334.02314 172.3
[M+HCOO]- 396.02408 198.1
[M+CH3COO]- 410.03973 188.1
[M+Na-2H]- 372.00055 182.1
[M]+ 351.02533 193.0
[M]- 351.02643 193.0
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.