CID 95439667

2375261-57-5

Structural Information

Molecular Formula
C12H17NO2
SMILES
COCCOC1=CC=C(C=C1)C2CNC2
InChI
InChI=1S/C12H17NO2/c1-14-6-7-15-12-4-2-10(3-5-12)11-8-13-9-11/h2-5,11,13H,6-9H2,1H3
InChIKey
KNHOJTBZVJSLBX-UHFFFAOYSA-N
Compound name
3-[4-(2-methoxyethoxy)phenyl]azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.12593 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.13321 144.7
[M+Na]+ 230.11515 152.3
[M+NH4]+ 225.15975 148.7
[M+K]+ 246.08909 147.8
[M-H]- 206.11865 144.4
[M+Na-2H]- 228.10060 149.2
[M]+ 207.12538 144.4
[M]- 207.12648 144.4
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.