CID 155820346

2567503-74-4

Structural Information

Molecular Formula
C12H24N2O3S
SMILES
CC(C)(C)OC(=O)NC1CC(C1)CCS(=N)(=O)C
InChI
InChI=1S/C12H24N2O3S/c1-12(2,3)17-11(15)14-10-7-9(8-10)5-6-18(4,13)16/h9-10,13H,5-8H2,1-4H3,(H,14,15)
InChIKey
GUTBTUCWNNPRQQ-UHFFFAOYSA-N
Compound name
tert-butyl N-[3-[2-(methylsulfonimidoyl)ethyl]cyclobutyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.15076 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.15804 166.4
[M+Na]+ 299.13998 167.8
[M-H]- 275.14348 168.5
[M+NH4]+ 294.18458 175.4
[M+K]+ 315.11392 169.3
[M+H-H2O]+ 259.14802 153.6
[M+HCOO]- 321.14896 179.5
[M+CH3COO]- 335.16461 203.8
[M+Na-2H]- 297.12543 166.9
[M]+ 276.15021 175.9
[M]- 276.15131 175.9
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.