CID 11208338

1-(4-bromophenyl)naphthalene

Structural Information

Molecular Formula
C16H11Br
SMILES
C1=CC=C2C(=C1)C=CC=C2C3=CC=C(C=C3)Br
InChI
InChI=1S/C16H11Br/c17-14-10-8-13(9-11-14)16-7-3-5-12-4-1-2-6-15(12)16/h1-11H
InChIKey
YRPIGRRBBMFFBE-UHFFFAOYSA-N
Compound name
1-(4-bromophenyl)naphthalene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1131
Patents

282.00443 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.01171 157.0
[M+Na]+ 304.99365 168.6
[M-H]- 280.99715 167.0
[M+NH4]+ 300.03825 177.4
[M+K]+ 320.96759 156.1
[M+H-H2O]+ 265.00169 156.5
[M+HCOO]- 327.00263 177.9
[M+CH3COO]- 341.01828 171.7
[M+Na-2H]- 302.97910 166.0
[M]+ 282.00388 174.8
[M]- 282.00498 174.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe