CID 80218761

1499573-40-8

Structural Information

Molecular Formula
C9H13ClN2
SMILES
CCNC(C)C1=NC=C(C=C1)Cl
InChI
InChI=1S/C9H13ClN2/c1-3-11-7(2)9-5-4-8(10)6-12-9/h4-7,11H,3H2,1-2H3
InChIKey
JPTPELFZMIAWNJ-UHFFFAOYSA-N
Compound name
1-(5-chloropyridin-2-yl)-N-ethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.07672 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.08400 138.7
[M+Na]+ 207.06594 146.7
[M-H]- 183.06944 140.8
[M+NH4]+ 202.11054 158.0
[M+K]+ 223.03988 143.1
[M+H-H2O]+ 167.07398 132.8
[M+HCOO]- 229.07492 157.4
[M+CH3COO]- 243.09057 184.6
[M+Na-2H]- 205.05139 144.9
[M]+ 184.07617 140.1
[M]- 184.07727 140.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.