CID 131002982

[(2-aminoethyl)imino](ethyl)methyl-lambda6-sulfanone

Structural Information

Molecular Formula
C5H14N2OS
SMILES
CCS(=NCCN)(=O)C
InChI
InChI=1S/C5H14N2OS/c1-3-9(2,8)7-5-4-6/h3-6H2,1-2H3
InChIKey
QFPMLBACGWDYHS-UHFFFAOYSA-N
Compound name
2-[(ethyl-methyl-oxo-lambda6-sulfanylidene)amino]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.08269 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.08997 130.6
[M+Na]+ 173.07191 137.9
[M-H]- 149.07541 132.1
[M+NH4]+ 168.11651 152.4
[M+K]+ 189.04585 136.6
[M+H-H2O]+ 133.07995 125.3
[M+HCOO]- 195.08089 151.0
[M+CH3COO]- 209.09654 179.5
[M+Na-2H]- 171.05736 135.1
[M]+ 150.08214 132.1
[M]- 150.08324 132.1
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.