CID 29819

Azetidine, 3-(m-methoxyphenyl)-3-propyl-

Structural Information

Molecular Formula
C13H19NO
SMILES
CCCC1(CNC1)C2=CC(=CC=C2)OC
InChI
InChI=1S/C13H19NO/c1-3-7-13(9-14-10-13)11-5-4-6-12(8-11)15-2/h4-6,8,14H,3,7,9-10H2,1-2H3
InChIKey
HFYKQNOJNNJVAS-UHFFFAOYSA-N
Compound name
3-(3-methoxyphenyl)-3-propylazetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.14667 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.15395 146.1
[M+Na]+ 228.13589 154.2
[M+NH4]+ 223.18049 152.0
[M+K]+ 244.10983 147.3
[M-H]- 204.13939 146.3
[M+Na-2H]- 226.12134 152.3
[M]+ 205.14612 146.3
[M]- 205.14722 146.3
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.