CID 3021562

2-naphthalenol, 5,6-dihydro-7-(1h-imidazol-1-yl)-

Structural Information

Molecular Formula
C13H12N2O
SMILES
C1CC(=CC2=C1C=CC(=C2)O)N3C=CN=C3
InChI
InChI=1S/C13H12N2O/c16-13-4-2-10-1-3-12(7-11(10)8-13)15-6-5-14-9-15/h2,4-9,16H,1,3H2
InChIKey
SDDDOAYMFJZBCK-UHFFFAOYSA-N
Compound name
7-imidazol-1-yl-5,6-dihydronaphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

212.09496 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.10224 146.5
[M+Na]+ 235.08418 161.1
[M+NH4]+ 230.12878 155.8
[M+K]+ 251.05812 155.3
[M-H]- 211.08768 150.2
[M+Na-2H]- 233.06963 154.7
[M]+ 212.09441 149.7
[M]- 212.09551 149.7
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