CID 154828528

[1-(1,2,3,4-tetrahydronaphthalen-1-yl)cyclobutyl]methanol

Structural Information

Molecular Formula
C15H20O
SMILES
C1CC(C2=CC=CC=C2C1)C3(CCC3)CO
InChI
InChI=1S/C15H20O/c16-11-15(9-4-10-15)14-8-3-6-12-5-1-2-7-13(12)14/h1-2,5,7,14,16H,3-4,6,8-11H2
InChIKey
VQJAQFGFNOFTHJ-UHFFFAOYSA-N
Compound name
[1-(1,2,3,4-tetrahydronaphthalen-1-yl)cyclobutyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.15141 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.15869 147.6
[M+Na]+ 239.14063 152.1
[M-H]- 215.14413 153.0
[M+NH4]+ 234.18523 161.9
[M+K]+ 255.11457 151.1
[M+H-H2O]+ 199.14867 136.7
[M+HCOO]- 261.14961 164.4
[M+CH3COO]- 275.16526 189.1
[M+Na-2H]- 237.12608 153.3
[M]+ 216.15086 151.7
[M]- 216.15196 151.7
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.