CID 162345510

Ns00133287

Structural Information

Molecular Formula
C12H11ClO2
SMILES
CC(C1=CC2=C(C=C(C=C2C=C1)O)Cl)O
InChI
InChI=1S/C12H11ClO2/c1-7(14)8-2-3-9-4-10(15)6-12(13)11(9)5-8/h2-7,14-15H,1H3
InChIKey
SRSYECXVUFUNJS-UHFFFAOYSA-N
Compound name
4-chloro-6-(1-hydroxyethyl)naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.04475 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.052026 143.9
[M+Na]+ 245.033968 153.9
[M-H]- 221.037474 146.4
[M+NH4]+ 240.078573 163.5
[M+K]+ 261.007908 148.6
[M+H-H2O]+ 205.042010 139.8
[M+HCOO]- 267.042951 159.3
[M+CH3COO]- 281.058601 184.9
[M+Na-2H]- 243.019416 149.2
[M]+ 222.04420142 145.6
[M]- 222.04529858 145.6
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.