CID 172407712

(z)-(2-aminovinyl)sulfanolate

Structural Information

Molecular Formula
C2H5NOS
SMILES
C(=C\SO)\N
InChI
InChI=1S/C2H5NOS/c3-1-2-5-4/h1-2,4H,3H2/b2-1-
InChIKey
UQSAPRQCLBGQDX-UPHRSURJSA-N
Compound name
(Z)-2-hydroxysulfanylethenamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

91.009186 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 92.016462 113.8
[M+Na]+ 113.99840 121.7
[M-H]- 90.001910 112.8
[M+NH4]+ 109.04301 136.6
[M+K]+ 129.97234 119.7
[M+H-H2O]+ 74.006446 109.5
[M+HCOO]- 136.00739 132.5
[M+CH3COO]- 150.02304 160.7
[M+Na-2H]- 111.98385 117.9
[M]+ 91.008637 112.4
[M]- 91.009735 112.4
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

No patent data available for this compound.