CID 72212004

1060811-74-6

Structural Information

Molecular Formula
C8H9ClN2
SMILES
C1CC1(C2=C(N=CC=C2)Cl)N
InChI
InChI=1S/C8H9ClN2/c9-7-6(2-1-5-11-7)8(10)3-4-8/h1-2,5H,3-4,10H2
InChIKey
GVOVNQWRTCQLAT-UHFFFAOYSA-N
Compound name
1-(2-chloropyridin-3-yl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.04543 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.05271 132.0
[M+Na]+ 191.03465 143.1
[M-H]- 167.03815 138.0
[M+NH4]+ 186.07925 148.7
[M+K]+ 207.00859 139.0
[M+H-H2O]+ 151.04269 126.5
[M+HCOO]- 213.04363 151.9
[M+CH3COO]- 227.05928 145.7
[M+Na-2H]- 189.02010 140.3
[M]+ 168.04488 134.0
[M]- 168.04598 134.0
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.