CID 3076669

2-(1-methylimidazol-5-yl)methoxy-1-(1-naphthyl)ethanol

Structural Information

Molecular Formula
C17H18N2O2
SMILES
CN1C=NC=C1COCC(C2=CC=CC3=CC=CC=C32)O
InChI
InChI=1S/C17H18N2O2/c1-19-12-18-9-14(19)10-21-11-17(20)16-8-4-6-13-5-2-3-7-15(13)16/h2-9,12,17,20H,10-11H2,1H3
InChIKey
BVJILTZHXVXKLO-UHFFFAOYSA-N
Compound name
2-[(3-methylimidazol-4-yl)methoxy]-1-naphthalen-1-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

282.13684 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.14412 165.6
[M+Na]+ 305.12606 180.3
[M+NH4]+ 300.17066 173.5
[M+K]+ 321.10000 174.5
[M-H]- 281.12956 168.8
[M+Na-2H]- 303.11151 173.7
[M]+ 282.13629 168.7
[M]- 282.13739 168.7
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

patents stripe