CID 21199187

93803-56-6

Structural Information

Molecular Formula
C26H38O2
SMILES
CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C2=C(C(=CC(=C2)C)C(C)(C)C)O)C(C)C
InChI
InChI=1S/C26H38O2/c1-15(2)22(18-11-16(3)13-20(23(18)27)25(5,6)7)19-12-17(4)14-21(24(19)28)26(8,9)10/h11-15,22,27-28H,1-10H3
InChIKey
YRVBJWCQIAOZEB-UHFFFAOYSA-N
Compound name
2-tert-butyl-6-[1-(3-tert-butyl-2-hydroxy-5-methylphenyl)-2-methylpropyl]-4-methylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

143
Patents

382.28717 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.29445 194.7
[M+Na]+ 405.27639 200.9
[M-H]- 381.27989 199.2
[M+NH4]+ 400.32099 206.6
[M+K]+ 421.25033 196.8
[M+H-H2O]+ 365.28443 188.5
[M+HCOO]- 427.28537 207.2
[M+CH3COO]- 441.30102 225.6
[M+Na-2H]- 403.26184 191.4
[M]+ 382.28662 197.3
[M]- 382.28772 197.3
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