CID 5937681

54-83-1

Structural Information

Molecular Formula
C17H14N2
SMILES
C1=CC2=C(C=C(C=C2)/C=C/C3=CC=C(C=C3)N)N=C1
InChI
InChI=1S/C17H14N2/c18-16-9-6-13(7-10-16)3-4-14-5-8-15-2-1-11-19-17(15)12-14/h1-12H,18H2/b4-3+
InChIKey
QAQIFRYHRUVXEJ-ONEGZZNKSA-N
Compound name
4-[(E)-2-quinolin-7-ylethenyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.11569 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.12297 156.4
[M+Na]+ 269.10491 164.6
[M-H]- 245.10841 162.1
[M+NH4]+ 264.14951 172.7
[M+K]+ 285.07885 157.9
[M+H-H2O]+ 229.11295 147.7
[M+HCOO]- 291.11389 178.8
[M+CH3COO]- 305.12954 168.2
[M+Na-2H]- 267.09036 164.1
[M]+ 246.11514 154.0
[M]- 246.11624 154.0
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.