CID 108319846

[3-fluoro-2-(3-methylmorpholin-4-yl)phenyl]methanol

Structural Information

Molecular Formula
C12H16FNO2
SMILES
CC1COCCN1C2=C(C=CC=C2F)CO
InChI
InChI=1S/C12H16FNO2/c1-9-8-16-6-5-14(9)12-10(7-15)3-2-4-11(12)13/h2-4,9,15H,5-8H2,1H3
InChIKey
YMYVLVVFGJPYEG-UHFFFAOYSA-N
Compound name
[3-fluoro-2-(3-methylmorpholin-4-yl)phenyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.1165 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.12378 150.1
[M+Na]+ 248.10572 157.0
[M-H]- 224.10922 153.2
[M+NH4]+ 243.15032 165.1
[M+K]+ 264.07966 154.8
[M+H-H2O]+ 208.11376 141.7
[M+HCOO]- 270.11470 166.5
[M+CH3COO]- 284.13035 187.3
[M+Na-2H]- 246.09117 153.8
[M]+ 225.11595 146.4
[M]- 225.11705 146.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.