CID 10964479

196929-78-9

Structural Information

Molecular Formula
C4H11NOS
SMILES
CC(C)(C)[S@@](=O)N
InChI
InChI=1S/C4H11NOS/c1-4(2,3)7(5)6/h5H2,1-3H3/t7-/m1/s1
InChIKey
CESUXLKAADQNTB-SSDOTTSWSA-N
Compound name
(R)-2-methylpropane-2-sulfinamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

43
References

17259
Patents

121.05614 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.06342 123.6
[M+Na]+ 144.04536 131.2
[M-H]- 120.04886 124.0
[M+NH4]+ 139.08996 146.1
[M+K]+ 160.01930 130.5
[M+H-H2O]+ 104.05340 119.3
[M+HCOO]- 166.05434 140.6
[M+CH3COO]- 180.06999 170.6
[M+Na-2H]- 142.03081 126.7
[M]+ 121.05559 123.8
[M]- 121.05669 123.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe