CID 13307489

1-(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)ethan-1-ol

Structural Information

Molecular Formula
C11H13NO2
SMILES
CC(C1CC(=NO1)C2=CC=CC=C2)O
InChI
InChI=1S/C11H13NO2/c1-8(13)11-7-10(12-14-11)9-5-3-2-4-6-9/h2-6,8,11,13H,7H2,1H3
InChIKey
QKHZHBZGPDGOAG-UHFFFAOYSA-N
Compound name
1-(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

191.09464 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.10192 141.2
[M+Na]+ 214.08386 153.5
[M+NH4]+ 209.12846 149.5
[M+K]+ 230.05780 149.9
[M-H]- 190.08736 145.1
[M+Na-2H]- 212.06931 147.9
[M]+ 191.09409 144.0
[M]- 191.09519 144.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe