CID 15356831

178181-52-7

Structural Information

Molecular Formula

C₇H₁₄FNO₂

SMILES

CC(C)(C)OC(=O)NCCF

InChI

InChI=1S/C7H14FNO2/c1-7(2,3)11-6(10)9-5-4-8/h4-5H2,1-3H3,(H,9,10)

InChIKey

JBIAEHWXSFAFFH-UHFFFAOYSA-N

Compound name

tert-butyl N-(2-fluoroethyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 78
Patents: 163.10086 Da
Monoisotopic Mass: 1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	164.10814	135.3
[M+Na]+	186.09008	142.0
[M-H]-	162.09358	134.4
[M+NH4]+	181.13468	156.1
[M+K]+	202.06402	142.2
[M+H-H2O]+	146.09812	129.9
[M+HCOO]-	208.09906	156.9
[M+CH3COO]-	222.11471	179.8
[M+Na-2H]-	184.07553	140.9
[M]+	163.10031	135.7
[M]-	163.10141	135.7

Literature stripe

literature stripe

Patent stripe

patents stripe