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-chloro-4-pyridinyl)-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]+ 183.068356 135.3
[M+Na]+ 205.050298 144.9
[M-H]- 181.053804 140.8
[M+NH4]+ 200.094903 149.4
[M+K]+ 221.024238 140.1
[M+H-H2O]+ 165.058340 128.7
[M+HCOO]- 227.059281 154.2
[M+CH3COO]- 241.074931 185.6
[M+Na-2H]- 203.035746 141.0
[M]+ 182.06053142 136.7
[M]- 182.06162858 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.