CID 4397174

2,3-dimethyl-4-methoxybenzyl alcohol

Structural Information

Molecular Formula
C10H14O2
SMILES
CC1=C(C=CC(=C1C)OC)CO
InChI
InChI=1S/C10H14O2/c1-7-8(2)10(12-3)5-4-9(7)6-11/h4-5,11H,6H2,1-3H3
InChIKey
FVNIOLGSUAIZPP-UHFFFAOYSA-N
Compound name
(4-methoxy-2,3-dimethylphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

166.09938 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.10666 133.5
[M+Na]+ 189.08860 142.9
[M-H]- 165.09210 136.7
[M+NH4]+ 184.13320 154.5
[M+K]+ 205.06254 141.1
[M+H-H2O]+ 149.09664 128.6
[M+HCOO]- 211.09758 156.8
[M+CH3COO]- 225.11323 179.2
[M+Na-2H]- 187.07405 138.8
[M]+ 166.09883 136.1
[M]- 166.09993 136.1
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