CID 66542

4-methoxy-1-naphthol

Structural Information

Molecular Formula
C11H10O2
SMILES
COC1=CC=C(C2=CC=CC=C21)O
InChI
InChI=1S/C11H10O2/c1-13-11-7-6-10(12)8-4-2-3-5-9(8)11/h2-7,12H,1H3
InChIKey
BOTGCZBEERTTDQ-UHFFFAOYSA-N
Compound name
4-methoxynaphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

7
References

7140
Patents

174.06808 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.075356 133.2
[M+Na]+ 197.057298 142.7
[M-H]- 173.060804 137.1
[M+NH4]+ 192.101903 154.4
[M+K]+ 213.031238 139.7
[M+H-H2O]+ 157.065340 127.8
[M+HCOO]- 219.066281 156.1
[M+CH3COO]- 233.081931 178.5
[M+Na-2H]- 195.042746 141.9
[M]+ 174.06753142 134.5
[M]- 174.06862858 134.5
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