CID 138040738

2243504-63-2

Structural Information

Molecular Formula
C10H12ClNO
SMILES
COC1=C(C(=CC=C1)Cl)[C@@H]2C[C@H]2N
InChI
InChI=1S/C10H12ClNO/c1-13-9-4-2-3-7(11)10(9)6-5-8(6)12/h2-4,6,8H,5,12H2,1H3/t6-,8-/m1/s1
InChIKey
OORPSEGWHZEIRB-HTRCEHHLSA-N
Compound name
(1R,2S)-2-(2-chloro-6-methoxyphenyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.06075 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.06803 137.9
[M+Na]+ 220.04997 153.0
[M+NH4]+ 215.09457 148.0
[M+K]+ 236.02391 147.4
[M-H]- 196.05347 149.1
[M+Na-2H]- 218.03542 148.4
[M]+ 197.06020 144.7
[M]- 197.06130 144.7
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.