CID 5112796

1-methyl-4-piperidinyl n-(4-fluorophenyl)carbamate

Structural Information

Molecular Formula
C13H17FN2O2
SMILES
CN1CCC(CC1)OC(=O)NC2=CC=C(C=C2)F
InChI
InChI=1S/C13H17FN2O2/c1-16-8-6-12(7-9-16)18-13(17)15-11-4-2-10(14)3-5-11/h2-5,12H,6-9H2,1H3,(H,15,17)
InChIKey
GYCYARKRWFZLJQ-UHFFFAOYSA-N
Compound name
(1-methylpiperidin-4-yl) N-(4-fluorophenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

252.12741 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.13469 156.8
[M+Na]+ 275.11663 161.8
[M-H]- 251.12013 160.1
[M+NH4]+ 270.16123 171.9
[M+K]+ 291.09057 159.1
[M+H-H2O]+ 235.12467 147.5
[M+HCOO]- 297.12561 175.4
[M+CH3COO]- 311.14126 195.3
[M+Na-2H]- 273.10208 159.5
[M]+ 252.12686 152.0
[M]- 252.12796 152.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.