CID 6447685

4-morpholineethanol, alpha-(p-fluorostyryl)-, hydrochloride

Structural Information

Molecular Formula
C14H18FNO2
SMILES
C1COCCN1CC(/C=C/C2=CC=C(C=C2)F)O
InChI
InChI=1S/C14H18FNO2/c15-13-4-1-12(2-5-13)3-6-14(17)11-16-7-9-18-10-8-16/h1-6,14,17H,7-11H2/b6-3+
InChIKey
ZBIRXKIYIZIDDI-ZZXKWVIFSA-N
Compound name
(E)-4-(4-fluorophenyl)-1-morpholin-4-ylbut-3-en-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.13216 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.13944 158.5
[M+Na]+ 274.12138 162.6
[M-H]- 250.12488 160.5
[M+NH4]+ 269.16598 171.6
[M+K]+ 290.09532 159.7
[M+H-H2O]+ 234.12942 149.4
[M+HCOO]- 296.13036 173.3
[M+CH3COO]- 310.14601 190.4
[M+Na-2H]- 272.10683 161.3
[M]+ 251.13161 153.2
[M]- 251.13271 153.2
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.