CID 143276

Methyl[2-(pyridin-4-yl)ethyl]amine

Structural Information

Molecular Formula
C8H12N2
SMILES
CNCCC1=CC=NC=C1
InChI
InChI=1S/C8H12N2/c1-9-5-2-8-3-6-10-7-4-8/h3-4,6-7,9H,2,5H2,1H3
InChIKey
QZBUGNURVLWJPK-UHFFFAOYSA-N
Compound name
N-methyl-2-pyridin-4-ylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

417
Patents

136.10005 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.10733 127.6
[M+Na]+ 159.08927 134.6
[M-H]- 135.09277 129.7
[M+NH4]+ 154.13387 147.8
[M+K]+ 175.06321 132.8
[M+H-H2O]+ 119.09731 120.9
[M+HCOO]- 181.09825 152.2
[M+CH3COO]- 195.11390 175.8
[M+Na-2H]- 157.07472 136.8
[M]+ 136.09950 126.9
[M]- 136.10060 126.9
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

patents stripe