CID 16494787

(1-methyl-2-pyridin-2-ylethyl)amine

Structural Information

Molecular Formula
C8H12N2
SMILES
CC(CC1=CC=CC=N1)N
InChI
InChI=1S/C8H12N2/c1-7(9)6-8-4-2-3-5-10-8/h2-5,7H,6,9H2,1H3
InChIKey
OKWKKGILOAMUGL-UHFFFAOYSA-N
Compound name
1-pyridin-2-ylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

181
Patents

136.10005 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.10733 128.7
[M+Na]+ 159.08927 135.5
[M-H]- 135.09277 130.4
[M+NH4]+ 154.13387 148.6
[M+K]+ 175.06321 133.8
[M+H-H2O]+ 119.09731 122.2
[M+HCOO]- 181.09825 151.8
[M+CH3COO]- 195.11390 175.9
[M+Na-2H]- 157.07472 135.6
[M]+ 136.09950 126.4
[M]- 136.10060 126.4
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