CID 71742826

1416440-21-5

Structural Information

Molecular Formula

SMILES

C1CC(CNC1)(CO)F

InChI

InChI=1S/C6H12FNO/c7-6(5-9)2-1-3-8-4-6/h8-9H,1-5H2

InChIKey

GLXPGATYWFFNOK-UHFFFAOYSA-N

Compound name

(3-fluoropiperidin-3-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 23
Patents: 133.09029 Da
Monoisotopic Mass: -0.2
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]+	134.09757	127.9
[M+Na]+	156.07951	133.5
[M-H]-	132.08301	125.5
[M+NH4]+	151.12411	148.7
[M+K]+	172.05345	131.5
[M+H-H2O]+	116.08755	122.0
[M+HCOO]-	178.08849	143.9
[M+CH3COO]-	192.10414	165.0
[M+Na-2H]-	154.06496	134.1
[M]+	133.08974	119.7
[M]-	133.09084	119.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe