CID 154814309

2551114-76-0

Structural Information

Molecular Formula
C9H18N2O2S
SMILES
CS(=N)(=O)C1CC2(CCOCC2)NC1
InChI
InChI=1S/C9H18N2O2S/c1-14(10,12)8-6-9(11-7-8)2-4-13-5-3-9/h8,10-11H,2-7H2,1H3
InChIKey
OTOBPSFFEQEQGA-UHFFFAOYSA-N
Compound name
imino-methyl-(8-oxa-1-azaspiro[4.5]decan-3-yl)-oxo-lambda6-sulfane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.1089 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.11618 147.4
[M+Na]+ 241.09812 154.3
[M+NH4]+ 236.14272 156.3
[M+K]+ 257.07206 148.6
[M-H]- 217.10162 149.2
[M+Na-2H]- 239.08357 151.2
[M]+ 218.10835 149.2
[M]- 218.10945 149.2
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.