CID 61484175

1250130-43-8

Structural Information

Molecular Formula
C7H17NO3S
SMILES
CC(C)CCOCCS(=O)(=O)N
InChI
InChI=1S/C7H17NO3S/c1-7(2)3-4-11-5-6-12(8,9)10/h7H,3-6H2,1-2H3,(H2,8,9,10)
InChIKey
QXVWOZKNKPDLNA-UHFFFAOYSA-N
Compound name
2-(3-methylbutoxy)ethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.09291 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.10019 142.6
[M+Na]+ 218.08213 148.8
[M-H]- 194.08563 142.2
[M+NH4]+ 213.12673 161.8
[M+K]+ 234.05607 147.5
[M+H-H2O]+ 178.09017 137.2
[M+HCOO]- 240.09111 159.3
[M+CH3COO]- 254.10676 183.6
[M+Na-2H]- 216.06758 144.5
[M]+ 195.09236 146.1
[M]- 195.09346 146.1
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.