CID 22931485

2-(aminooxy)ethane-1-thiol hydrochloride

Structural Information

Molecular Formula
C2H7NOS
SMILES
C(CS)ON
InChI
InChI=1S/C2H7NOS/c3-4-1-2-5/h5H,1-3H2
InChIKey
NXPBRABYBTZAFZ-UHFFFAOYSA-N
Compound name
O-(2-sulfanylethyl)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

105
Patents

93.02483 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 94.032106 114.0
[M+Na]+ 116.014048 122.0
[M-H]- 92.017554 114.4
[M+NH4]+ 111.058653 137.6
[M+K]+ 131.987988 121.6
[M+H-H2O]+ 76.022090 109.4
[M+HCOO]- 138.023031 134.1
[M+CH3COO]- 152.038681 165.0
[M+Na-2H]- 113.999496 118.7
[M]+ 93.02428142 115.4
[M]- 93.02537858 115.4
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