CID 88757

N-methyl-1-(pyridin-2-yl)methanamine

Structural Information

Molecular Formula
C7H10N2
SMILES
CNCC1=CC=CC=N1
InChI
InChI=1S/C7H10N2/c1-8-6-7-4-2-3-5-9-7/h2-5,8H,6H2,1H3
InChIKey
OOTKJPZEEVPWCR-UHFFFAOYSA-N
Compound name
N-methyl-1-pyridin-2-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

1705
Patents

122.0844 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 123.091676 123.0
[M+Na]+ 145.073618 130.4
[M-H]- 121.077124 125.3
[M+NH4]+ 140.118223 143.7
[M+K]+ 161.047558 128.9
[M+H-H2O]+ 105.081660 116.5
[M+HCOO]- 167.082601 148.0
[M+CH3COO]- 181.098251 172.7
[M+Na-2H]- 143.059066 132.8
[M]+ 122.08385142 121.9
[M]- 122.08494858 121.9
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