CID 137944418

2287332-16-3

Structural Information

Molecular Formula

C₆H₁₀F₃NO₂

SMILES

C1C(OC(CN1)C(F)(F)F)CO

InChI

InChI=1S/C6H10F3NO2/c7-6(8,9)5-2-10-1-4(3-11)12-5/h4-5,10-11H,1-3H2

InChIKey

ZBHWZKGOGDZROC-UHFFFAOYSA-N

Compound name

[6-(trifluoromethyl)morpholin-2-yl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 185.06636 Da
Monoisotopic Mass: 0.0
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]+	186.073636	136.2
[M+Na]+	208.055578	142.4
[M-H]-	184.059084	131.9
[M+NH4]+	203.100183	151.8
[M+K]+	224.029518	141.0
[M+H-H2O]+	168.063620	128.2
[M+HCOO]-	230.064561	147.7
[M+CH3COO]-	244.080211	173.9
[M+Na-2H]-	206.041026	141.0
[M]+	185.06581142	127.1
[M]-	185.06690858	127.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe