CID 3032507

Usaf mk-34

Structural Information

Molecular Formula
C38H76N2S2
SMILES
CCCCCCCCCCCCCCCCCCNC(=S)C(=S)NCCCCCCCCCCCCCCCCCC
InChI
InChI=1S/C38H76N2S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-37(41)38(42)40-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-36H2,1-2H3,(H,39,41)(H,40,42)
InChIKey
HAEZRGWJGIOSQY-UHFFFAOYSA-N
Compound name
N,N'-dioctadecylethanedithioamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

624.545 Da
Monoisotopic Mass

18.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 625.55228 295.4
[M+Na]+ 647.53422 299.8
[M-H]- 623.53772 273.6
[M+NH4]+ 642.57882 289.9
[M+K]+ 663.50816 302.4
[M+H-H2O]+ 607.54226 248.6
[M+HCOO]- 669.54320 292.6
[M+CH3COO]- 683.55885 274.9
[M+Na-2H]- 645.51967 274.4
[M]+ 624.54445 292.7
[M]- 624.54555 292.7
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