CID 19623287

1820734-50-6

Structural Information

Molecular Formula
C10H17N3O3S
SMILES
CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)N
InChI
InChI=1S/C10H17N3O3S/c1-7-10(8(2)16-12-7)17(14,15)13-5-3-9(11)4-6-13/h9H,3-6,11H2,1-2H3
InChIKey
RZFDINULGDDBOB-UHFFFAOYSA-N
Compound name
1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.09906 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.10634 157.5
[M+Na]+ 282.08828 165.7
[M-H]- 258.09178 162.2
[M+NH4]+ 277.13288 172.5
[M+K]+ 298.06222 163.7
[M+H-H2O]+ 242.09632 150.8
[M+HCOO]- 304.09726 171.0
[M+CH3COO]- 318.11291 193.1
[M+Na-2H]- 280.07373 158.2
[M]+ 259.09851 157.5
[M]- 259.09961 157.5
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.