CID 86811552

Tert-butyl 2-[n-(morpholin-2-ylmethyl)methanesulfonamido]acetate

Structural Information

Molecular Formula
C12H24N2O5S
SMILES
CC(C)(C)OC(=O)CN(CC1CNCCO1)S(=O)(=O)C
InChI
InChI=1S/C12H24N2O5S/c1-12(2,3)19-11(15)9-14(20(4,16)17)8-10-7-13-5-6-18-10/h10,13H,5-9H2,1-4H3
InChIKey
QGURZAVBJJGIJP-UHFFFAOYSA-N
Compound name
tert-butyl 2-[methylsulfonyl(morpholin-2-ylmethyl)amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.1406 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.14788 169.9
[M+Na]+ 331.12982 174.9
[M+NH4]+ 326.17442 173.7
[M+K]+ 347.10376 172.3
[M-H]- 307.13332 168.3
[M+Na-2H]- 329.11527 170.0
[M]+ 308.14005 170.1
[M]- 308.14115 170.1
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.