CID 75481601

Azetidin-3-yl n-(3-fluorophenyl)carbamate hydrochloride

Structural Information

Molecular Formula
C10H11FN2O2
SMILES
C1C(CN1)OC(=O)NC2=CC(=CC=C2)F
InChI
InChI=1S/C10H11FN2O2/c11-7-2-1-3-8(4-7)13-10(14)15-9-5-12-6-9/h1-4,9,12H,5-6H2,(H,13,14)
InChIKey
VFTXBJDAXKJPRL-UHFFFAOYSA-N
Compound name
azetidin-3-yl N-(3-fluorophenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.08046 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.087736 143.7
[M+Na]+ 233.069678 148.5
[M-H]- 209.073184 145.9
[M+NH4]+ 228.114283 153.3
[M+K]+ 249.043618 149.0
[M+H-H2O]+ 193.077720 129.7
[M+HCOO]- 255.078661 162.8
[M+CH3COO]- 269.094311 187.2
[M+Na-2H]- 231.055126 148.1
[M]+ 210.07991142 148.1
[M]- 210.08100858 148.1
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.