CID 3859696

Methyl 1,4-dimethoxy-2-naphthoate

Structural Information

Molecular Formula
C14H14O4
SMILES
COC1=CC(=C(C2=CC=CC=C21)OC)C(=O)OC
InChI
InChI=1S/C14H14O4/c1-16-12-8-11(14(15)18-3)13(17-2)10-7-5-4-6-9(10)12/h4-8H,1-3H3
InChIKey
YCLPKVULIDNCMN-UHFFFAOYSA-N
Compound name
methyl 1,4-dimethoxynaphthalene-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

246.0892 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.09648 152.3
[M+Na]+ 269.07842 166.3
[M+NH4]+ 264.12302 160.4
[M+K]+ 285.05236 159.9
[M-H]- 245.08192 154.5
[M+Na-2H]- 267.06387 158.5
[M]+ 246.08865 154.9
[M]- 246.08975 154.9
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