CID 9555417

Bis(1-methyl-2-pyrrolidinylidene)sulfamide

Structural Information

Molecular Formula
C10H18N4O2S
SMILES
CN1/C(=N/S(=O)(=O)/N=C\2/N(CCC2)C)/CCC1
InChI
InChI=1S/C10H18N4O2S/c1-13-7-3-5-9(13)11-17(15,16)12-10-6-4-8-14(10)2/h3-8H2,1-2H3/b11-9+,12-10+
InChIKey
CAPXLMOTKXUTQY-WGDLNXRISA-N
Compound name
(E)-1-methyl-N-[(E)-(1-methylpyrrolidin-2-ylidene)amino]sulfonylpyrrolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.11505 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.12233 160.0
[M+Na]+ 281.10427 166.9
[M-H]- 257.10777 166.8
[M+NH4]+ 276.14887 179.1
[M+K]+ 297.07821 165.4
[M+H-H2O]+ 241.11231 152.7
[M+HCOO]- 303.11325 178.4
[M+CH3COO]- 317.12890 197.8
[M+Na-2H]- 279.08972 159.7
[M]+ 258.11450 159.6
[M]- 258.11560 159.6
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

No patent data available for this compound.