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

27
Patents

182.04984 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.057116 134.9
[M+Na]+ 205.039058 143.6
[M-H]- 181.042564 137.9
[M+NH4]+ 200.083663 156.4
[M+K]+ 221.012998 138.8
[M+H-H2O]+ 165.047100 130.6
[M+HCOO]- 227.048041 150.3
[M+CH3COO]- 241.063691 148.1
[M+Na-2H]- 203.024506 141.6
[M]+ 182.04929142 133.5
[M]- 182.05038858 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