CID 141748

2,2'-dimethyl-1,1'-binaphthalene

Structural Information

Molecular Formula
C22H18
SMILES
CC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)C
InChI
InChI=1S/C22H18/c1-15-11-13-17-7-3-5-9-19(17)21(15)22-16(2)12-14-18-8-4-6-10-20(18)22/h3-14H,1-2H3
InChIKey
KDHFKMDVFWYSPT-UHFFFAOYSA-N
Compound name
2-methyl-1-(2-methylnaphthalen-1-yl)naphthalene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

499
Patents

282.14084 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.14812 166.6
[M+Na]+ 305.13006 187.5
[M+NH4]+ 300.17466 178.7
[M+K]+ 321.10400 175.1
[M-H]- 281.13356 175.5
[M+Na-2H]- 303.11551 179.1
[M]+ 282.14029 172.8
[M]- 282.14139 172.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe