CID 11275168

4-(azetidin-1-yl)benzaldehyde

Structural Information

Molecular Formula
C10H11NO
SMILES
C1CN(C1)C2=CC=C(C=C2)C=O
InChI
InChI=1S/C10H11NO/c12-8-9-2-4-10(5-3-9)11-6-1-7-11/h2-5,8H,1,6-7H2
InChIKey
HXDXHWQUDGABHT-UHFFFAOYSA-N
Compound name
4-(azetidin-1-yl)benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

161.08406 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.09134 130.7
[M+Na]+ 184.07328 139.8
[M+NH4]+ 179.11788 135.8
[M+K]+ 200.04722 134.9
[M-H]- 160.07678 131.3
[M+Na-2H]- 182.05873 136.8
[M]+ 161.08351 131.0
[M]- 161.08461 131.0
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