CID 143265

Tetramethyltetraselenafulvalene

Structural Information

Molecular Formula
C10H12Se4
SMILES
CC1=C([Se]C(=C2[Se]C(=C([Se]2)C)C)[Se]1)C
InChI
InChI=1S/C10H12Se4/c1-5-6(2)12-9(11-5)10-13-7(3)8(4)14-10/h1-4H3
InChIKey
YMWLPMGFZYFLRP-UHFFFAOYSA-N
Compound name
2-(4,5-dimethyl-1,3-diselenol-2-ylidene)-4,5-dimethyl-1,3-diselenole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

573
Patents

451.75998 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 452.76726 192.7
[M+Na]+ 474.74920 199.3
[M-H]- 450.75270 197.9
[M+NH4]+ 469.79380 214.2
[M+K]+ 490.72314 194.4
[M+H-H2O]+ 434.75724 185.2
[M+HCOO]- 496.75818 213.1
[M+CH3COO]- 510.77383 195.3
[M+Na-2H]- 472.73465 186.3
[M]+ 451.75943 191.2
[M]- 451.76053 191.2
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