CID 11941

4,4'-dimethylbiphenyl

Structural Information

Molecular Formula
C14H14
SMILES
CC1=CC=C(C=C1)C2=CC=C(C=C2)C
InChI
InChI=1S/C14H14/c1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14/h3-10H,1-2H3
InChIKey
RZTDESRVPFKCBH-UHFFFAOYSA-N
Compound name
1-methyl-4-(4-methylphenyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

10455
Patents

182.10954 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.11682 138.3
[M+Na]+ 205.09876 147.0
[M-H]- 181.10226 145.5
[M+NH4]+ 200.14336 158.6
[M+K]+ 221.07270 143.2
[M+H-H2O]+ 165.10680 131.8
[M+HCOO]- 227.10774 162.8
[M+CH3COO]- 241.12339 184.4
[M+Na-2H]- 203.08421 145.2
[M]+ 182.10899 138.2
[M]- 182.11009 138.2
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.