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-chloro-3-pyridinyl)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]+ 169.052706 132.0
[M+Na]+ 191.034648 143.1
[M-H]- 167.038154 138.0
[M+NH4]+ 186.079253 148.7
[M+K]+ 207.008588 139.0
[M+H-H2O]+ 151.042690 126.5
[M+HCOO]- 213.043631 151.9
[M+CH3COO]- 227.059281 145.7
[M+Na-2H]- 189.020096 140.3
[M]+ 168.04488142 134.0
[M]- 168.04597858 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.