CID 165869177

En300-1577674

Structural Information

Molecular Formula
C10H20ClNO4S
SMILES
CC(C)(C)OC(=O)NC(C)(C)CCS(=O)(=O)Cl
InChI
InChI=1S/C10H20ClNO4S/c1-9(2,3)16-8(13)12-10(4,5)6-7-17(11,14)15/h6-7H2,1-5H3,(H,12,13)
InChIKey
RSFZLXIEBHMDPS-UHFFFAOYSA-N
Compound name
tert-butyl N-(4-chlorosulfonyl-2-methylbutan-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.08017 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.08745 162.1
[M+Na]+ 308.06939 168.7
[M-H]- 284.07289 162.8
[M+NH4]+ 303.11399 179.2
[M+K]+ 324.04333 166.2
[M+H-H2O]+ 268.07743 158.5
[M+HCOO]- 330.07837 171.8
[M+CH3COO]- 344.09402 197.0
[M+Na-2H]- 306.05484 166.0
[M]+ 285.07962 169.0
[M]- 285.08072 169.0
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.