CID 132327830

N-tert-butyl-1-formylcyclobutane-1-sulfonamide

Structural Information

Molecular Formula
C9H17NO3S
SMILES
CC(C)(C)NS(=O)(=O)C1(CCC1)C=O
InChI
InChI=1S/C9H17NO3S/c1-8(2,3)10-14(12,13)9(7-11)5-4-6-9/h7,10H,4-6H2,1-3H3
InChIKey
AIWBQBFVEQCSSM-UHFFFAOYSA-N
Compound name
N-tert-butyl-1-formylcyclobutane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.09291 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.10019 146.9
[M+Na]+ 242.08213 151.1
[M-H]- 218.08563 149.8
[M+NH4]+ 237.12673 160.4
[M+K]+ 258.05607 152.8
[M+H-H2O]+ 202.09017 137.1
[M+HCOO]- 264.09111 161.3
[M+CH3COO]- 278.10676 189.0
[M+Na-2H]- 240.06758 152.0
[M]+ 219.09236 157.3
[M]- 219.09346 157.3
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.