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]+ 217.158686 147.6
[M+Na]+ 239.140628 152.1
[M-H]- 215.144134 153.0
[M+NH4]+ 234.185233 161.9
[M+K]+ 255.114568 151.1
[M+H-H2O]+ 199.148670 136.7
[M+HCOO]- 261.149611 164.4
[M+CH3COO]- 275.165261 189.1
[M+Na-2H]- 237.126076 153.3
[M]+ 216.15086142 151.7
[M]- 216.15195858 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.