CID 165588255

2763583-93-1

Structural Information

Molecular Formula
C10H12O2
SMILES
C[C@@H]1[C@@H](OC2=CC=CC=C12)CO
InChI
InChI=1S/C10H12O2/c1-7-8-4-2-3-5-9(8)12-10(7)6-11/h2-5,7,10-11H,6H2,1H3/t7-,10-/m0/s1
InChIKey
YXDVMJFEKYTFRB-XVKPBYJWSA-N
Compound name
[(2R,3S)-3-methyl-2,3-dihydro-1-benzofuran-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.08372 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.09100 132.3
[M+Na]+ 187.07294 141.3
[M-H]- 163.07644 136.6
[M+NH4]+ 182.11754 154.4
[M+K]+ 203.04688 139.7
[M+H-H2O]+ 147.08098 127.9
[M+HCOO]- 209.08192 153.9
[M+CH3COO]- 223.09757 175.7
[M+Na-2H]- 185.05839 138.9
[M]+ 164.08317 133.2
[M]- 164.08427 133.2
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.