CID 68258

5,6,7,8-tetrahydro-1-naphthol

Structural Information

Molecular Formula
C10H12O
SMILES
C1CCC2=C(C1)C=CC=C2O
InChI
InChI=1S/C10H12O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7,11H,1-2,4,6H2
InChIKey
SCWNNOCLLOHZIG-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydronaphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

1857
Patents

148.08882 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.09610 128.7
[M+Na]+ 171.07804 135.6
[M-H]- 147.08154 131.6
[M+NH4]+ 166.12264 150.4
[M+K]+ 187.05198 132.7
[M+H-H2O]+ 131.08608 123.5
[M+HCOO]- 193.08702 148.7
[M+CH3COO]- 207.10267 172.9
[M+Na-2H]- 169.06349 136.6
[M]+ 148.08827 124.8
[M]- 148.08937 124.8
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