CID 136746

1-phenylcyclobutan-1-ol

Structural Information

Molecular Formula
C10H12O
SMILES
C1CC(C1)(C2=CC=CC=C2)O
InChI
InChI=1S/C10H12O/c11-10(7-4-8-10)9-5-2-1-3-6-9/h1-3,5-6,11H,4,7-8H2
InChIKey
LHXASHUXCRQHPZ-UHFFFAOYSA-N
Compound name
1-phenylcyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

223
Patents

148.08882 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.09610 128.5
[M+Na]+ 171.07804 137.1
[M+NH4]+ 166.12264 135.8
[M+K]+ 187.05198 130.5
[M-H]- 147.08154 129.7
[M+Na-2H]- 169.06349 136.2
[M]+ 148.08827 129.1
[M]- 148.08937 129.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe