CID 22063588

Tert-butyl n-(3-sulfamoylpropyl)carbamate

Structural Information

Molecular Formula
C8H18N2O4S
SMILES
CC(C)(C)OC(=O)NCCCS(=O)(=O)N
InChI
InChI=1S/C8H18N2O4S/c1-8(2,3)14-7(11)10-5-4-6-15(9,12)13/h4-6H2,1-3H3,(H,10,11)(H2,9,12,13)
InChIKey
UFORZZXGNFYDKG-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-sulfamoylpropyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

238.09872 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.10600 152.8
[M+Na]+ 261.08794 158.3
[M-H]- 237.09144 152.4
[M+NH4]+ 256.13254 170.0
[M+K]+ 277.06188 157.1
[M+H-H2O]+ 221.09598 147.2
[M+HCOO]- 283.09692 169.1
[M+CH3COO]- 297.11257 191.2
[M+Na-2H]- 259.07339 156.0
[M]+ 238.09817 155.7
[M]- 238.09927 155.7
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