CID 104319282

4-(2,2-dimethylthiomorpholin-4-yl)butan-2-ol

Structural Information

Molecular Formula
C10H21NOS
SMILES
CC(CCN1CCSC(C1)(C)C)O
InChI
InChI=1S/C10H21NOS/c1-9(12)4-5-11-6-7-13-10(2,3)8-11/h9,12H,4-8H2,1-3H3
InChIKey
FTAJUHLNFAMZGU-UHFFFAOYSA-N
Compound name
4-(2,2-dimethylthiomorpholin-4-yl)butan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.13438 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.14166 147.4
[M+Na]+ 226.12360 156.6
[M+NH4]+ 221.16820 157.1
[M+K]+ 242.09754 147.4
[M-H]- 202.12710 148.3
[M+Na-2H]- 224.10905 151.9
[M]+ 203.13383 149.4
[M]- 203.13493 149.4
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.