CID 53787101

Propane-1-sulfinamide

Structural Information

Molecular Formula
C3H9NOS
SMILES
CCCS(=O)N
InChI
InChI=1S/C3H9NOS/c1-2-3-6(4)5/h2-4H2,1H3
InChIKey
XWRDGWGYYMWOFB-UHFFFAOYSA-N
Compound name
propane-1-sulfinamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

128
Patents

107.04048 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.04776 119.5
[M+Na]+ 130.02970 128.6
[M+NH4]+ 125.07430 128.0
[M+K]+ 146.00364 122.3
[M-H]- 106.03320 119.6
[M+Na-2H]- 128.01515 122.7
[M]+ 107.03993 121.0
[M]- 107.04103 121.0
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

patents stripe