CID 111370

68797-71-7

Structural Information

Molecular Formula
C14H20O
SMILES
CC(C)(C)C1=CC2=C(CC(CC2)O)C=C1
InChI
InChI=1S/C14H20O/c1-14(2,3)12-6-4-11-9-13(15)7-5-10(11)8-12/h4,6,8,13,15H,5,7,9H2,1-3H3
InChIKey
LLLRKSFANNQEDZ-UHFFFAOYSA-N
Compound name
6-tert-butyl-1,2,3,4-tetrahydronaphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.15141 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.15869 147.5
[M+Na]+ 227.14063 154.1
[M-H]- 203.14413 150.4
[M+NH4]+ 222.18523 167.5
[M+K]+ 243.11457 150.8
[M+H-H2O]+ 187.14867 142.4
[M+HCOO]- 249.14961 164.5
[M+CH3COO]- 263.16526 185.9
[M+Na-2H]- 225.12608 153.2
[M]+ 204.15086 144.9
[M]- 204.15196 144.9
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.