CID 11271730

(1,3-bis(2,6-diisopropyl phenyl)imidazol-2-ylidene)(1,3-divinyl-1,1,3,3-tetramethyl disiloxane)platinum(0)

Structural Information

Molecular Formula
C27H36N2
SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=[C-]2)C3=C(C=CC=C3C(C)C)C(C)C
InChI
InChI=1S/C27H36N2/c1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8/h9-16,18-21H,1-8H3
InChIKey
VYCIHDBIKGRENI-UHFFFAOYSA-N
Compound name
1,3-bis[2,6-di(propan-2-yl)phenyl]-2H-imidazol-1-ium-2-ide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

17
Patents

388.28784 Da
Monoisotopic Mass

8.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.29512 200.8
[M+Na]+ 411.27706 205.1
[M-H]- 387.28056 206.4
[M+NH4]+ 406.32166 210.6
[M+K]+ 427.25100 194.0
[M+H-H2O]+ 371.28510 195.7
[M+HCOO]- 433.28604 215.1
[M+CH3COO]- 447.30169 220.9
[M+Na-2H]- 409.26251 195.3
[M]+ 388.28729 199.0
[M]- 388.28839 199.0
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