CID 96498

N,n-diethylpyridine-2-ethylamine

Structural Information

Molecular Formula
C11H18N2
SMILES
CCN(CC)CCC1=CC=CC=N1
InChI
InChI=1S/C11H18N2/c1-3-13(4-2)10-8-11-7-5-6-9-12-11/h5-7,9H,3-4,8,10H2,1-2H3
InChIKey
PMDWLPBLYZHLHW-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-pyridin-2-ylethanamine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

53
Patents

178.147 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.154276 141.6
[M+Na]+ 201.136218 147.4
[M-H]- 177.139724 144.6
[M+NH4]+ 196.180823 160.7
[M+K]+ 217.110158 146.3
[M+H-H2O]+ 161.144260 134.0
[M+HCOO]- 223.145201 165.7
[M+CH3COO]- 237.160851 188.4
[M+Na-2H]- 199.121666 148.4
[M]+ 178.14645142 143.3
[M]- 178.14754858 143.3
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