CID 10496393

69898-56-2

Structural Information

Molecular Formula
C22H30O2
SMILES
CC(C)(C)C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C(C)(C)C
InChI
InChI=1S/C22H30O2/c1-21(2,3)17-7-11-19(12-8-17)23-15-16-24-20-13-9-18(10-14-20)22(4,5)6/h7-14H,15-16H2,1-6H3
InChIKey
NIHMPJAREIUKNW-UHFFFAOYSA-N
Compound name
1-tert-butyl-4-[2-(4-tert-butylphenoxy)ethoxy]benzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

326.22458 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.23186 182.7
[M+Na]+ 349.21380 188.6
[M-H]- 325.21730 189.0
[M+NH4]+ 344.25840 197.3
[M+K]+ 365.18774 185.2
[M+H-H2O]+ 309.22184 175.1
[M+HCOO]- 371.22278 201.6
[M+CH3COO]- 385.23843 211.9
[M+Na-2H]- 347.19925 186.7
[M]+ 326.22403 187.1
[M]- 326.22513 187.1
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