CID 24206583

1-(2-chlorophenyl)cyclopropanamine hydrochloride

Structural Information

Molecular Formula
C9H10ClN
SMILES
C1CC1(C2=CC=CC=C2Cl)N
InChI
InChI=1S/C9H10ClN/c10-8-4-2-1-3-7(8)9(11)5-6-9/h1-4H,5-6,11H2
InChIKey
YBGXYERMKZBANM-UHFFFAOYSA-N
Compound name
1-(2-chlorophenyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

167.05017 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.057446 128.9
[M+Na]+ 190.039388 139.6
[M-H]- 166.042894 136.4
[M+NH4]+ 185.083993 147.0
[M+K]+ 206.013328 135.7
[M+H-H2O]+ 150.047430 124.4
[M+HCOO]- 212.048371 149.8
[M+CH3COO]- 226.064021 143.1
[M+Na-2H]- 188.024836 137.0
[M]+ 167.04962142 130.9
[M]- 167.05071858 130.9
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

patents stripe