CID 25665

Diallyl-p-aminophenylmethane hydrochloride

Structural Information

Molecular Formula
C13H17N
SMILES
C=CCC(CC=C)C1=CC=C(C=C1)N
InChI
InChI=1S/C13H17N/c1-3-5-11(6-4-2)12-7-9-13(14)10-8-12/h3-4,7-11H,1-2,5-6,14H2
InChIKey
DCPXIXLZYVHPDR-UHFFFAOYSA-N
Compound name
4-hepta-1,6-dien-4-ylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.1361 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.14338 145.2
[M+Na]+ 210.12532 156.9
[M+NH4]+ 205.16992 153.5
[M+K]+ 226.09926 149.3
[M-H]- 186.12882 147.9
[M+Na-2H]- 208.11077 151.3
[M]+ 187.13555 147.5
[M]- 187.13665 147.5
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.