CID 71743199

(1-(6-chloropyridin-3-yl)cyclopropyl)methanamine

Structural Information

Molecular Formula
C9H11ClN2
SMILES
C1CC1(CN)C2=CN=C(C=C2)Cl
InChI
InChI=1S/C9H11ClN2/c10-8-2-1-7(5-12-8)9(6-11)3-4-9/h1-2,5H,3-4,6,11H2
InChIKey
YZNUBCNBWKBCQQ-UHFFFAOYSA-N
Compound name
[1-(6-chloro-3-pyridinyl)cyclopropyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.06108 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.068356 136.2
[M+Na]+ 205.050298 146.8
[M-H]- 181.053804 142.0
[M+NH4]+ 200.094903 152.3
[M+K]+ 221.024238 142.6
[M+H-H2O]+ 165.058340 130.5
[M+HCOO]- 227.059281 155.7
[M+CH3COO]- 241.074931 149.5
[M+Na-2H]- 203.035746 143.9
[M]+ 182.06053142 138.5
[M]- 182.06162858 138.5
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.