CID 9548022

5,6,7,8-tetrahydronaphthalene-1,2-diol

Structural Information

Molecular Formula
C10H12O2
SMILES
C1CCC2=C(C1)C=CC(=C2O)O
InChI
InChI=1S/C10H12O2/c11-9-6-5-7-3-1-2-4-8(7)10(9)12/h5-6,11-12H,1-4H2
InChIKey
CNOYQLOSBYLHEK-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydronaphthalene-1,2-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

9
Patents

164.08372 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.09100 132.5
[M+Na]+ 187.07294 145.2
[M+NH4]+ 182.11754 142.0
[M+K]+ 203.04688 138.8
[M-H]- 163.07644 134.8
[M+Na-2H]- 185.05839 138.3
[M]+ 164.08317 134.9
[M]- 164.08427 134.9
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