CID 15578709

(3-methoxy-2-methylphenyl)methanol

Structural Information

Molecular Formula
C9H12O2
SMILES
CC1=C(C=CC=C1OC)CO
InChI
InChI=1S/C9H12O2/c1-7-8(6-10)4-3-5-9(7)11-2/h3-5,10H,6H2,1-2H3
InChIKey
CRKISCPFEDTNCG-UHFFFAOYSA-N
Compound name
(3-methoxy-2-methylphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

61
Patents

152.08372 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.090996 129.6
[M+Na]+ 175.072938 138.5
[M-H]- 151.076444 132.6
[M+NH4]+ 170.117543 150.8
[M+K]+ 191.046878 136.8
[M+H-H2O]+ 135.080980 124.6
[M+HCOO]- 197.081921 153.2
[M+CH3COO]- 211.097571 175.0
[M+Na-2H]- 173.058386 136.1
[M]+ 152.08317142 131.4
[M]- 152.08426858 131.4
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

patents stripe