CID 56828108

1354951-68-0

Structural Information

Molecular Formula
C14H15NO
SMILES
C1C(CN1)OCC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C14H15NO/c1-2-7-14-11(4-1)5-3-6-12(14)10-16-13-8-15-9-13/h1-7,13,15H,8-10H2
InChIKey
UAXOQORTZLHHQG-UHFFFAOYSA-N
Compound name
3-(naphthalen-1-ylmethoxy)azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.11537 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.12265 142.6
[M+Na]+ 236.10459 148.6
[M-H]- 212.10809 146.9
[M+NH4]+ 231.14919 153.8
[M+K]+ 252.07853 147.4
[M+H-H2O]+ 196.11263 130.0
[M+HCOO]- 258.11357 161.3
[M+CH3COO]- 272.12922 188.5
[M+Na-2H]- 234.09004 150.1
[M]+ 213.11482 149.3
[M]- 213.11592 149.3
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.