CID 117548023

N-methyl-3-phenyloxetan-3-amine hydrochloride

Structural Information

Molecular Formula
C10H13NO
SMILES
CNC1(COC1)C2=CC=CC=C2
InChI
InChI=1S/C10H13NO/c1-11-10(7-12-8-10)9-5-3-2-4-6-9/h2-6,11H,7-8H2,1H3
InChIKey
DVVNQFGEMCQTQK-UHFFFAOYSA-N
Compound name
N-methyl-3-phenyloxetan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

163.09972 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.106996 130.8
[M+Na]+ 186.088938 136.4
[M-H]- 162.092444 138.1
[M+NH4]+ 181.133543 145.2
[M+K]+ 202.062878 138.9
[M+H-H2O]+ 146.096980 120.1
[M+HCOO]- 208.097921 153.7
[M+CH3COO]- 222.113571 182.2
[M+Na-2H]- 184.074386 140.5
[M]+ 163.09917142 138.5
[M]- 163.10026858 138.5
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