CID 21959854

2-methylpropane-1-sulfinamide

Structural Information

Molecular Formula
C4H11NOS
SMILES
CC(C)CS(=O)N
InChI
InChI=1S/C4H11NOS/c1-4(2)3-7(5)6/h4H,3,5H2,1-2H3
InChIKey
XSRCFERAMLNCDQ-UHFFFAOYSA-N
Compound name
2-methylpropane-1-sulfinamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1001
Patents

121.05614 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.063416 123.6
[M+Na]+ 144.045358 130.4
[M-H]- 120.048864 123.8
[M+NH4]+ 139.089963 145.8
[M+K]+ 160.019298 129.8
[M+H-H2O]+ 104.053400 118.7
[M+HCOO]- 166.054341 141.0
[M+CH3COO]- 180.069991 171.9
[M+Na-2H]- 142.030806 124.8
[M]+ 121.05559142 123.7
[M]- 121.05668858 123.7
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

patents stripe