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]+ 339.26824 188.7
[M+Na]+ 361.25018 193.0
[M-H]- 337.25368 192.9
[M+NH4]+ 356.29478 201.9
[M+K]+ 377.22412 187.0
[M+H-H2O]+ 321.25822 180.3
[M+HCOO]- 383.25916 207.3
[M+CH3COO]- 397.27481 215.6
[M+Na-2H]- 359.23563 187.4
[M]+ 338.26041 191.4
[M]- 338.26151 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.