CID 147254265

[(2s)-morpholin-2-yl]methanethiol hydrochloride

Structural Information

Molecular Formula
C5H11NOS
SMILES
C1CO[C@H](CN1)CS
InChI
InChI=1S/C5H11NOS/c8-4-5-3-6-1-2-7-5/h5-6,8H,1-4H2/t5-/m1/s1
InChIKey
CNGZTXTYUFPYRC-RXMQYKEDSA-N
Compound name
[(2R)-morpholin-2-yl]methanethiol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

133.05614 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.063416 125.1
[M+Na]+ 156.045358 131.1
[M-H]- 132.048864 126.2
[M+NH4]+ 151.089963 144.2
[M+K]+ 172.019298 130.5
[M+H-H2O]+ 116.053400 119.5
[M+HCOO]- 178.054341 138.1
[M+CH3COO]- 192.069991 166.1
[M+Na-2H]- 154.030806 129.4
[M]+ 133.05559142 122.1
[M]- 133.05668858 122.1
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.