CID 142513127

Tert-butyl 6-sulfamoyl-2-azaspiro[3.3]heptane-2-carboxylate

Structural Information

Molecular Formula
C11H20N2O4S
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CC(C2)S(=O)(=O)N
InChI
InChI=1S/C11H20N2O4S/c1-10(2,3)17-9(14)13-6-11(7-13)4-8(5-11)18(12,15)16/h8H,4-7H2,1-3H3,(H2,12,15,16)
InChIKey
RTPBYNMVSHTAEI-UHFFFAOYSA-N
Compound name
tert-butyl 6-sulfamoyl-2-azaspiro[3.3]heptane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

276.11438 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.12166 157.2
[M+Na]+ 299.10360 158.1
[M-H]- 275.10710 159.4
[M+NH4]+ 294.14820 160.2
[M+K]+ 315.07754 163.2
[M+H-H2O]+ 259.11164 141.4
[M+HCOO]- 321.11258 165.6
[M+CH3COO]- 335.12823 206.0
[M+Na-2H]- 297.08905 158.7
[M]+ 276.11383 173.7
[M]- 276.11493 173.7
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

patents stripe