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]+ 134.06342 125.1
[M+Na]+ 156.04536 131.1
[M-H]- 132.04886 126.2
[M+NH4]+ 151.08996 144.2
[M+K]+ 172.01930 130.5
[M+H-H2O]+ 116.05340 119.5
[M+HCOO]- 178.05434 138.1
[M+CH3COO]- 192.06999 166.1
[M+Na-2H]- 154.03081 129.4
[M]+ 133.05559 122.1
[M]- 133.05669 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.