CID 5792256

4-[(z)-inden-1-ylidenemethyl]aniline

Structural Information

Molecular Formula
C16H13N
SMILES
C1=CC=C\2C(=C1)C=C/C2=C/C3=CC=C(C=C3)N
InChI
InChI=1S/C16H13N/c17-15-9-5-12(6-10-15)11-14-8-7-13-3-1-2-4-16(13)14/h1-11H,17H2/b14-11-
InChIKey
GISMNWZLKDONAA-KAMYIIQDSA-N
Compound name
4-[(Z)-inden-1-ylidenemethyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.1048 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.11208 149.9
[M+Na]+ 242.09402 164.8
[M+NH4]+ 237.13862 160.4
[M+K]+ 258.06796 157.2
[M-H]- 218.09752 156.2
[M+Na-2H]- 240.07947 159.4
[M]+ 219.10425 153.9
[M]- 219.10535 153.9
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.