CID 56604677

N-(2-chlorobenzyl)oxetan-3-amine

Structural Information

Molecular Formula
C10H12ClNO
SMILES
C1C(CO1)NCC2=CC=CC=C2Cl
InChI
InChI=1S/C10H12ClNO/c11-10-4-2-1-3-8(10)5-12-9-6-13-7-9/h1-4,9,12H,5-7H2
InChIKey
MWKLFUTXXQJRKZ-UHFFFAOYSA-N
Compound name
N-[(2-chlorophenyl)methyl]oxetan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.06075 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.06803 135.9
[M+Na]+ 220.04997 145.2
[M+NH4]+ 215.09457 141.7
[M+K]+ 236.02391 139.9
[M-H]- 196.05347 139.1
[M+Na-2H]- 218.03542 141.9
[M]+ 197.06020 137.3
[M]- 197.06130 137.3
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.