CID 53487354

(r)-2-methylbutane-2-sulfinamide

Structural Information

Molecular Formula
C5H13NOS
SMILES
CCC(C)(C)[S@@](=O)N
InChI
InChI=1S/C5H13NOS/c1-4-5(2,3)8(6)7/h4,6H2,1-3H3/t8-/m1/s1
InChIKey
XMGHCOUHHPRMOH-MRVPVSSYSA-N
Compound name
(R)-2-methylbutane-2-sulfinamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

135.0718 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.07908 127.9
[M+Na]+ 158.06102 135.0
[M-H]- 134.06452 128.1
[M+NH4]+ 153.10562 149.8
[M+K]+ 174.03496 134.0
[M+H-H2O]+ 118.06906 123.4
[M+HCOO]- 180.07000 144.6
[M+CH3COO]- 194.08565 174.3
[M+Na-2H]- 156.04647 130.5
[M]+ 135.07125 128.5
[M]- 135.07235 128.5
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