CID 165346291

Disulfide, bis[5-(1,1-dimethylethyl)-2-methylphenyl]

Structural Information

Molecular Formula
C22H30S2
SMILES
CC1=C(C=C(C=C1)C(C)(C)C)SSC2=C(C=CC(=C2)C(C)(C)C)C
InChI
InChI=1S/C22H30S2/c1-15-9-11-17(21(3,4)5)13-19(15)23-24-20-14-18(22(6,7)8)12-10-16(20)2/h9-14H,1-8H3
InChIKey
YDJLOKPHOXLVIK-UHFFFAOYSA-N
Compound name
4-tert-butyl-2-[(5-tert-butyl-2-methylphenyl)disulfanyl]-1-methylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.1789 Da
Monoisotopic Mass

8.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.18618 183.4
[M+Na]+ 381.16812 191.1
[M-H]- 357.17162 189.8
[M+NH4]+ 376.21272 198.1
[M+K]+ 397.14206 184.4
[M+H-H2O]+ 341.17616 176.3
[M+HCOO]- 403.17710 191.5
[M+CH3COO]- 417.19275 217.9
[M+Na-2H]- 379.15357 181.9
[M]+ 358.17835 188.6
[M]- 358.17945 188.6
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.