CID 13900257

4-(2-phenylethyl)pyridin-2-amine hydrochloride

Structural Information

Molecular Formula
C13H14N2
SMILES
C1=CC=C(C=C1)CCC2=CC(=NC=C2)N
InChI
InChI=1S/C13H14N2/c14-13-10-12(8-9-15-13)7-6-11-4-2-1-3-5-11/h1-5,8-10H,6-7H2,(H2,14,15)
InChIKey
VDMBMDXLWKXMIQ-UHFFFAOYSA-N
Compound name
4-(2-phenylethyl)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

198.11569 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.12297 143.8
[M+Na]+ 221.10491 151.0
[M-H]- 197.10841 148.6
[M+NH4]+ 216.14951 161.0
[M+K]+ 237.07885 146.6
[M+H-H2O]+ 181.11295 135.7
[M+HCOO]- 243.11389 167.6
[M+CH3COO]- 257.12954 156.3
[M+Na-2H]- 219.09036 151.2
[M]+ 198.11514 141.7
[M]- 198.11624 141.7
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

patents stripe