CID 56971676

883442-46-4

Structural Information

Molecular Formula

C₆H₁₁FO₂

SMILES

C1COCCC1(CO)F

InChI

InChI=1S/C6H11FO2/c7-6(5-8)1-3-9-4-2-6/h8H,1-5H2

InChIKey

SCZDHDHAWKBYHY-UHFFFAOYSA-N

Compound name

(4-fluorooxan-4-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 388
Patents: 134.07431 Da
Monoisotopic Mass: 0.1
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]+	135.081586	125.1
[M+Na]+	157.063528	131.2
[M-H]-	133.067034	126.3
[M+NH4]+	152.108133	146.7
[M+K]+	173.037468	131.7
[M+H-H2O]+	117.071570	120.0
[M+HCOO]-	179.072511	143.3
[M+CH3COO]-	193.088161	166.9
[M+Na-2H]-	155.048976	133.0
[M]+	134.07376142	120.4
[M]-	134.07485858	120.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe