CID 136576300

2225136-09-2

Structural Information

Molecular Formula
C13H24N2O4S
SMILES
CC(C)(C)OC(=O)NC1CNCC12CCS(=O)(=O)CC2
InChI
InChI=1S/C13H24N2O4S/c1-12(2,3)19-11(16)15-10-8-14-9-13(10)4-6-20(17,18)7-5-13/h10,14H,4-9H2,1-3H3,(H,15,16)
InChIKey
KLIJNPDDNAMPCL-UHFFFAOYSA-N
Compound name
tert-butyl N-(8,8-dioxo-8lambda6-thia-2-azaspiro[4.5]decan-4-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.1457 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.15298 168.6
[M+Na]+ 327.13492 173.3
[M-H]- 303.13842 170.4
[M+NH4]+ 322.17952 187.6
[M+K]+ 343.10886 171.0
[M+H-H2O]+ 287.14296 164.4
[M+HCOO]- 349.14390 178.6
[M+CH3COO]- 363.15955 195.5
[M+Na-2H]- 325.12037 171.0
[M]+ 304.14515 165.9
[M]- 304.14625 165.9
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.