CID 43489192

Ethyl[(4-methoxyphenyl)(pyridin-3-yl)methyl]amine

Structural Information

Molecular Formula
C15H18N2O
SMILES
CCNC(C1=CC=C(C=C1)OC)C2=CN=CC=C2
InChI
InChI=1S/C15H18N2O/c1-3-17-15(13-5-4-10-16-11-13)12-6-8-14(18-2)9-7-12/h4-11,15,17H,3H2,1-2H3
InChIKey
FXKDFZKZUPPGMA-UHFFFAOYSA-N
Compound name
N-[(4-methoxyphenyl)-pyridin-3-ylmethyl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

242.1419 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.149176 156.2
[M+Na]+ 265.131118 162.1
[M-H]- 241.134624 161.2
[M+NH4]+ 260.175723 171.8
[M+K]+ 281.105058 158.7
[M+H-H2O]+ 225.139160 147.5
[M+HCOO]- 287.140101 179.2
[M+CH3COO]- 301.155751 196.5
[M+Na-2H]- 263.116566 162.4
[M]+ 242.14135142 156.6
[M]- 242.14244858 156.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.