CID 3019204

2-nonyl-6-(1-phenylethyl)-p-cresol

Structural Information

Molecular Formula
C24H34O
SMILES
CCCCCCCCCC1=C(C(=CC(=C1)C)C(C)C2=CC=CC=C2)O
InChI
InChI=1S/C24H34O/c1-4-5-6-7-8-9-11-16-22-17-19(2)18-23(24(22)25)20(3)21-14-12-10-13-15-21/h10,12-15,17-18,20,25H,4-9,11,16H2,1-3H3
InChIKey
HMPGNFHAOKAQFD-UHFFFAOYSA-N
Compound name
4-methyl-2-nonyl-6-(1-phenylethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.26096 Da
Monoisotopic Mass

8.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.268236 188.7
[M+Na]+ 361.250178 193.0
[M-H]- 337.253684 192.9
[M+NH4]+ 356.294783 201.9
[M+K]+ 377.224118 187.0
[M+H-H2O]+ 321.258220 180.3
[M+HCOO]- 383.259161 207.3
[M+CH3COO]- 397.274811 215.6
[M+Na-2H]- 359.235626 187.4
[M]+ 338.26041142 191.4
[M]- 338.26150858 191.4
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.