CID 118813452

4-(difluoromethyl)naphthalen-2-ol

Structural Information

Molecular Formula
C11H8F2O
SMILES
C1=CC=C2C(=C1)C=C(C=C2C(F)F)O
InChI
InChI=1S/C11H8F2O/c12-11(13)10-6-8(14)5-7-3-1-2-4-9(7)10/h1-6,11,14H
InChIKey
QZJUFSZUQMYRKX-UHFFFAOYSA-N
Compound name
4-(difluoromethyl)naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.05432 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.06160 136.1
[M+Na]+ 217.04354 145.4
[M-H]- 193.04704 137.2
[M+NH4]+ 212.08814 156.2
[M+K]+ 233.01748 141.4
[M+H-H2O]+ 177.05158 128.9
[M+HCOO]- 239.05252 155.5
[M+CH3COO]- 253.06817 182.8
[M+Na-2H]- 215.02899 142.2
[M]+ 194.05377 133.0
[M]- 194.05487 133.0
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.