CID 153214758

3-amino-1-imino-1lambda6-thiolan-1-one

Structural Information

Molecular Formula
C4H10N2OS
SMILES
C1CS(=N)(=O)CC1N
InChI
InChI=1S/C4H10N2OS/c5-4-1-2-8(6,7)3-4/h4,6H,1-3,5H2
InChIKey
WMMKWEORTZMIQD-UHFFFAOYSA-N
Compound name
1-imino-1-oxothiolan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

134.05139 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.05867 125.1
[M+Na]+ 157.04061 132.6
[M+NH4]+ 152.08521 134.9
[M+K]+ 173.01455 126.2
[M-H]- 133.04411 126.6
[M+Na-2H]- 155.02606 130.1
[M]+ 134.05084 126.7
[M]- 134.05194 126.7
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.