CID 583758

Benzene, 1,1'-(1,1,2,2-tetramethyl-1,2-ethanediyl)bis[4-methyl-

Structural Information

Molecular Formula
C20H26
SMILES
CC1=CC=C(C=C1)C(C)(C)C(C)(C)C2=CC=C(C=C2)C
InChI
InChI=1S/C20H26/c1-15-7-11-17(12-8-15)19(3,4)20(5,6)18-13-9-16(2)10-14-18/h7-14H,1-6H3
InChIKey
DTVHTGANUBTKPO-UHFFFAOYSA-N
Compound name
1-[2,3-dimethyl-3-(4-methylphenyl)butan-2-yl]-4-methylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

217
Patents

266.20346 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.210736 164.8
[M+Na]+ 289.192678 171.7
[M-H]- 265.196184 171.6
[M+NH4]+ 284.237283 181.9
[M+K]+ 305.166618 167.5
[M+H-H2O]+ 249.200720 158.1
[M+HCOO]- 311.201661 184.0
[M+CH3COO]- 325.217311 203.3
[M+Na-2H]- 287.178126 169.9
[M]+ 266.20291142 165.9
[M]- 266.20400858 165.9
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