CID 32599

24702-66-7

Structural Information

Molecular Formula
C18H26N2
SMILES
C[N+](C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)[N+](C)(C)C
InChI
InChI=1S/C18H26N2/c1-19(2,3)17-11-7-15(8-12-17)16-9-13-18(14-10-16)20(4,5)6/h7-14H,1-6H3/q+2
InChIKey
IQYXODYDRLRVCI-UHFFFAOYSA-N
Compound name
trimethyl-[4-[4-(trimethylazaniumyl)phenyl]phenyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

270.2096 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.21688 161.4
[M+Na]+ 293.19882 167.7
[M-H]- 269.20232 171.2
[M+NH4]+ 288.24342 178.6
[M+K]+ 309.17276 154.3
[M+H-H2O]+ 253.20686 159.5
[M+HCOO]- 315.20780 184.9
[M+CH3COO]- 329.22345 199.7
[M+Na-2H]- 291.18427 173.8
[M]+ 270.20905 160.7
[M]- 270.21015 160.8
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