CID 24694541

[3-(morpholin-4-yl)thiolan-3-yl]methanamine

Structural Information

Molecular Formula
C9H18N2OS
SMILES
C1CSCC1(CN)N2CCOCC2
InChI
InChI=1S/C9H18N2OS/c10-7-9(1-6-13-8-9)11-2-4-12-5-3-11/h1-8,10H2
InChIKey
DLNJDBFJPOCELE-UHFFFAOYSA-N
Compound name
(3-morpholin-4-ylthiolan-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.11398 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.12126 143.8
[M+Na]+ 225.10320 148.0
[M-H]- 201.10670 148.1
[M+NH4]+ 220.14780 163.5
[M+K]+ 241.07714 147.2
[M+H-H2O]+ 185.11124 137.5
[M+HCOO]- 247.11218 156.9
[M+CH3COO]- 261.12783 155.0
[M+Na-2H]- 223.08865 145.6
[M]+ 202.11343 138.4
[M]- 202.11453 138.4
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.