CID 20203333

4-chloro-5,6,7,8-tetrahydronaphthalen-1-ol

Structural Information

Molecular Formula
C10H11ClO
SMILES
C1CCC2=C(C=CC(=C2C1)O)Cl
InChI
InChI=1S/C10H11ClO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h5-6,12H,1-4H2
InChIKey
DUQUFSQRQYYYBG-UHFFFAOYSA-N
Compound name
4-chloro-5,6,7,8-tetrahydronaphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

182.04984 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.05712 134.9
[M+Na]+ 205.03906 143.6
[M-H]- 181.04256 137.9
[M+NH4]+ 200.08366 156.4
[M+K]+ 221.01300 138.8
[M+H-H2O]+ 165.04710 130.6
[M+HCOO]- 227.04804 150.3
[M+CH3COO]- 241.06369 148.1
[M+Na-2H]- 203.02451 141.6
[M]+ 182.04929 133.5
[M]- 182.05039 133.5
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