CID 57355117

Bis(11-azidoundecyl) disulfide

Structural Information

Molecular Formula
C22H44N6S2
SMILES
C(CCCCCN=[N+]=[N-])CCCCCSSCCCCCCCCCCCN=[N+]=[N-]
InChI
InChI=1S/C22H44N6S2/c23-27-25-19-15-11-7-3-1-5-9-13-17-21-29-30-22-18-14-10-6-2-4-8-12-16-20-26-28-24/h1-22H2
InChIKey
GIGNSCLNVXDBBG-UHFFFAOYSA-N
Compound name
1-azido-11-(11-azidoundecyldisulfanyl)undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

456.3069 Da
Monoisotopic Mass

11.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 457.31418 230.3
[M+Na]+ 479.29612 231.6
[M+NH4]+ 474.34072 234.7
[M+K]+ 495.27006 237.6
[M-H]- 455.29962 222.4
[M+Na-2H]- 477.28157 219.9
[M]+ 456.30635 228.8
[M]- 456.30745 228.8
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