CID 11736104

907544-20-1

Structural Information

Molecular Formula

C₁₀H₁₉FN₂O₂

SMILES

CC(C)(C)OC(=O)N1CC[C@H]([C@H](C1)F)N

InChI

InChI=1S/C10H19FN2O2/c1-10(2,3)15-9(14)13-5-4-8(12)7(11)6-13/h7-8H,4-6,12H2,1-3H3/t7-,8+/m0/s1

InChIKey

ZQRYPCAUVKVMLZ-JGVFFNPUSA-N

Compound name

tert-butyl (3S,4R)-4-amino-3-fluoropiperidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 561
Patents: 218.14305 Da
Monoisotopic Mass: 0.8
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]+	219.15033	150.7
[M+Na]+	241.13227	156.3
[M-H]-	217.13577	150.7
[M+NH4]+	236.17687	167.7
[M+K]+	257.10621	155.3
[M+H-H2O]+	201.14031	143.8
[M+HCOO]-	263.14125	166.7
[M+CH3COO]-	277.15690	189.7
[M+Na-2H]-	239.11772	152.2
[M]+	218.14250	145.8
[M]-	218.14360	145.8

Literature stripe

literature stripe

Patent stripe

patents stripe