CID 165652113

2751611-98-8

Structural Information

Molecular Formula
C11H14O2
SMILES
COC1(CC(C1)O)C2=CC=CC=C2
InChI
InChI=1S/C11H14O2/c1-13-11(7-10(12)8-11)9-5-3-2-4-6-9/h2-6,10,12H,7-8H2,1H3
InChIKey
OLMYTVWWVKUSGD-UHFFFAOYSA-N
Compound name
3-methoxy-3-phenylcyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.09938 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.10666 135.6
[M+Na]+ 201.08860 142.1
[M-H]- 177.09210 141.3
[M+NH4]+ 196.13320 150.7
[M+K]+ 217.06254 143.0
[M+H-H2O]+ 161.09664 125.7
[M+HCOO]- 223.09758 156.9
[M+CH3COO]- 237.11323 181.1
[M+Na-2H]- 199.07405 142.5
[M]+ 178.09883 143.8
[M]- 178.09993 143.8
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

No patent data available for this compound.