CID 121552294

2-{[ethyl(methyl)oxo-lambda6-sulfanylidene]amino}acetonitrile

Structural Information

Molecular Formula
C5H10N2OS
SMILES
CCS(=NCC#N)(=O)C
InChI
InChI=1S/C5H10N2OS/c1-3-9(2,8)7-5-4-6/h3,5H2,1-2H3
InChIKey
AYFVNVLIQCAEJC-UHFFFAOYSA-N
Compound name
2-[(ethyl-methyl-oxo-lambda6-sulfanylidene)amino]acetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

146.05139 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.05867 129.0
[M+Na]+ 169.04061 138.0
[M+NH4]+ 164.08521 133.5
[M+K]+ 185.01455 128.7
[M-H]- 145.04411 121.8
[M+Na-2H]- 167.02606 130.6
[M]+ 146.05084 127.7
[M]- 146.05194 127.7
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

No patent data available for this compound.