CID 55294168

2418661-50-2

Structural Information

Molecular Formula
C9H11ClN2
SMILES
C1CC1C(C2=CC(=NC=C2)Cl)N
InChI
InChI=1S/C9H11ClN2/c10-8-5-7(3-4-12-8)9(11)6-1-2-6/h3-6,9H,1-2,11H2
InChIKey
BIRRNNURRYIDRN-UHFFFAOYSA-N
Compound name
(2-chloropyridin-4-yl)-cyclopropylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.06108 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.06836 135.3
[M+Na]+ 205.05030 144.9
[M-H]- 181.05380 140.8
[M+NH4]+ 200.09490 149.4
[M+K]+ 221.02424 140.1
[M+H-H2O]+ 165.05834 128.7
[M+HCOO]- 227.05928 154.2
[M+CH3COO]- 241.07493 185.6
[M+Na-2H]- 203.03575 141.0
[M]+ 182.06053 136.7
[M]- 182.06163 136.7
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.