CID 15563047

Schembl1418058

Structural Information

Molecular Formula
C6H13NOS
SMILES
CCSN1CCOCC1
InChI
InChI=1S/C6H13NOS/c1-2-9-7-3-5-8-6-4-7/h2-6H2,1H3
InChIKey
BUNSTGGAUQAYHE-UHFFFAOYSA-N
Compound name
4-ethylsulfanylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

93
Patents

147.0718 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.079076 129.0
[M+Na]+ 170.061018 134.9
[M-H]- 146.064524 131.3
[M+NH4]+ 165.105623 148.2
[M+K]+ 186.034958 135.1
[M+H-H2O]+ 130.069060 122.9
[M+HCOO]- 192.070001 143.2
[M+CH3COO]- 206.085651 171.8
[M+Na-2H]- 168.046466 133.2
[M]+ 147.07125142 128.2
[M]- 147.07234858 128.2
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