CID 214477

Pyridine, 1,4-dihydro-4-imino-1-phenethyl-, monohydrochloride

Structural Information

Molecular Formula
C13H14N2
SMILES
C1=CC=C(C=C1)CCN2C=CC(=N)C=C2
InChI
InChI=1S/C13H14N2/c14-13-7-10-15(11-8-13)9-6-12-4-2-1-3-5-12/h1-5,7-8,10-11,14H,6,9H2
InChIKey
GWBHTLIHECZIDU-UHFFFAOYSA-N
Compound name
1-(2-phenylethyl)pyridin-4-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.11569 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.12297 142.6
[M+Na]+ 221.10491 150.1
[M-H]- 197.10841 147.9
[M+NH4]+ 216.14951 160.0
[M+K]+ 237.07885 145.4
[M+H-H2O]+ 181.11295 134.5
[M+HCOO]- 243.11389 167.2
[M+CH3COO]- 257.12954 186.9
[M+Na-2H]- 219.09036 151.0
[M]+ 198.11514 140.8
[M]- 198.11624 140.8
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.