CID 10012701

(6-methoxynaphthalen-2-yl)methanol

Structural Information

Molecular Formula
C12H12O2
SMILES
COC1=CC2=C(C=C1)C=C(C=C2)CO
InChI
InChI=1S/C12H12O2/c1-14-12-5-4-10-6-9(8-13)2-3-11(10)7-12/h2-7,13H,8H2,1H3
InChIKey
YKZCYRHZTSJCAO-UHFFFAOYSA-N
Compound name
(6-methoxynaphthalen-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

106
Patents

188.08372 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.090996 138.0
[M+Na]+ 211.072938 147.0
[M-H]- 187.076444 141.7
[M+NH4]+ 206.117543 158.5
[M+K]+ 227.046878 143.8
[M+H-H2O]+ 171.080980 132.3
[M+HCOO]- 233.081921 160.5
[M+CH3COO]- 247.097571 181.5
[M+Na-2H]- 209.058386 146.1
[M]+ 188.08317142 139.6
[M]- 188.08426858 139.6
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