CID 28293863

(1s)-7-fluoro-1,2,3,4-tetrahydronaphthalen-1-ol

Structural Information

Molecular Formula
C10H11FO
SMILES
C1C[C@@H](C2=C(C1)C=CC(=C2)F)O
InChI
InChI=1S/C10H11FO/c11-8-5-4-7-2-1-3-10(12)9(7)6-8/h4-6,10,12H,1-3H2/t10-/m0/s1
InChIKey
QNORPDDVMCJPRL-JTQLQIEISA-N
Compound name
(1S)-7-fluoro-1,2,3,4-tetrahydronaphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

166.07939 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.086666 131.4
[M+Na]+ 189.068608 139.3
[M-H]- 165.072114 133.3
[M+NH4]+ 184.113213 152.7
[M+K]+ 205.042548 136.0
[M+H-H2O]+ 149.076650 125.4
[M+HCOO]- 211.077591 150.4
[M+CH3COO]- 225.093241 176.8
[M+Na-2H]- 187.054056 138.0
[M]+ 166.07884142 126.8
[M]- 166.07993858 126.8
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