CID 130726719

2,2-dimethyl-4-(3-methylbutyl)thiomorpholine

Structural Information

Molecular Formula
C11H23NS
SMILES
CC(C)CCN1CCSC(C1)(C)C
InChI
InChI=1S/C11H23NS/c1-10(2)5-6-12-7-8-13-11(3,4)9-12/h10H,5-9H2,1-4H3
InChIKey
UUAKWGAEFNFSOZ-UHFFFAOYSA-N
Compound name
2,2-dimethyl-4-(3-methylbutyl)thiomorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.15512 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.16240 148.5
[M+Na]+ 224.14434 158.6
[M+NH4]+ 219.18894 159.0
[M+K]+ 240.11828 148.2
[M-H]- 200.14784 150.4
[M+Na-2H]- 222.12979 153.8
[M]+ 201.15457 151.1
[M]- 201.15567 151.1
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.