CID 165945521

(3-aminocyclopentyl)(imino)methyl-lambda6-sulfanone dihydrochloride

Structural Information

Molecular Formula
C6H14N2OS
SMILES
CS(=N)(=O)C1CCC(C1)N
InChI
InChI=1S/C6H14N2OS/c1-10(8,9)6-3-2-5(7)4-6/h5-6,8H,2-4,7H2,1H3
InChIKey
TUEDIQSPXOBHFF-UHFFFAOYSA-N
Compound name
3-(methylsulfonimidoyl)cyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

162.08269 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.08997 133.7
[M+Na]+ 185.07191 140.4
[M-H]- 161.07541 136.8
[M+NH4]+ 180.11651 155.9
[M+K]+ 201.04585 138.0
[M+H-H2O]+ 145.07995 128.6
[M+HCOO]- 207.08089 151.8
[M+CH3COO]- 221.09654 177.8
[M+Na-2H]- 183.05736 135.7
[M]+ 162.08214 129.9
[M]- 162.08324 129.9
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.