CID 135770173

2-(3-((4-bromophenyl)imino)-1-propenyl)phenol

Structural Information

Molecular Formula
C15H12BrNO
SMILES
C1=CC=C(C(=C1)/C=C/C=NC2=CC=C(C=C2)Br)O
InChI
InChI=1S/C15H12BrNO/c16-13-7-9-14(10-8-13)17-11-3-5-12-4-1-2-6-15(12)18/h1-11,18H/b5-3+,17-11?
InChIKey
GSVMOAPTOCYNOY-OWJSUJKRSA-N
Compound name
2-[(E)-3-(4-bromophenyl)iminoprop-1-enyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.01022 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.01750 159.9
[M+Na]+ 323.99944 170.5
[M-H]- 300.00294 168.9
[M+NH4]+ 319.04404 178.5
[M+K]+ 339.97338 157.2
[M+H-H2O]+ 284.00748 158.4
[M+HCOO]- 346.00842 182.9
[M+CH3COO]- 360.02407 200.5
[M+Na-2H]- 321.98489 167.1
[M]+ 301.00967 177.9
[M]- 301.01077 177.9
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.