CID 15837775

189696-30-8

Structural Information

Molecular Formula
C23H38O
SMILES
CCCC1CCC(CC1)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C
InChI
InChI=1S/C23H38O/c1-8-9-16-10-12-17(13-11-16)18-14-19(22(2,3)4)21(24)20(15-18)23(5,6)7/h14-17,24H,8-13H2,1-7H3
InChIKey
PBEMFWGJRHQMEI-UHFFFAOYSA-N
Compound name
2,6-ditert-butyl-4-(4-propylcyclohexyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

327
Patents

330.29227 Da
Monoisotopic Mass

8.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.29955 185.4
[M+Na]+ 353.28149 189.3
[M-H]- 329.28499 189.8
[M+NH4]+ 348.32609 199.6
[M+K]+ 369.25543 185.0
[M+H-H2O]+ 313.28953 179.0
[M+HCOO]- 375.29047 198.0
[M+CH3COO]- 389.30612 213.9
[M+Na-2H]- 351.26694 184.4
[M]+ 330.29172 183.5
[M]- 330.29282 183.5
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

patents stripe