CID 3032818

Naproxol

Structural Information

Molecular Formula
C14H16O2
SMILES
C[C@H](CO)C1=CC2=C(C=C1)C=C(C=C2)OC
InChI
InChI=1S/C14H16O2/c1-10(9-15)11-3-4-13-8-14(16-2)6-5-12(13)7-11/h3-8,10,15H,9H2,1-2H3/t10-/m1/s1
InChIKey
LTRANDSQVZFZDG-SNVBAGLBSA-N
Compound name
(2S)-2-(6-methoxynaphthalen-2-yl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

4375
Patents

216.11504 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.12232 147.8
[M+Na]+ 239.10426 155.5
[M-H]- 215.10776 151.1
[M+NH4]+ 234.14886 167.1
[M+K]+ 255.07820 152.4
[M+H-H2O]+ 199.11230 141.7
[M+HCOO]- 261.11324 168.5
[M+CH3COO]- 275.12889 188.4
[M+Na-2H]- 237.08971 153.5
[M]+ 216.11449 149.4
[M]- 216.11559 149.4
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

No patent data available for this compound.