CID 3021557

1h-imidazole, 1-(3,4-dihydro-7-methoxy-2-naphthalenyl)-

Structural Information

Molecular Formula
C14H14N2O
SMILES
COC1=CC2=C(CCC(=C2)N3C=CN=C3)C=C1
InChI
InChI=1S/C14H14N2O/c1-17-14-5-3-11-2-4-13(8-12(11)9-14)16-7-6-15-10-16/h3,5-10H,2,4H2,1H3
InChIKey
CRAMMDHXKKDBIB-UHFFFAOYSA-N
Compound name
1-(7-methoxy-3,4-dihydronaphthalen-2-yl)imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

226.11061 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.11789 150.7
[M+Na]+ 249.09983 165.6
[M+NH4]+ 244.14443 160.1
[M+K]+ 265.07377 159.2
[M-H]- 225.10333 154.8
[M+Na-2H]- 247.08528 159.2
[M]+ 226.11006 154.0
[M]- 226.11116 154.0
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