CID 215600

Brn 1244469

Structural Information

Molecular Formula
C10H17NO2S2
SMILES
C1CCC2(CC1)SCC(S2)COC(=O)N
InChI
InChI=1S/C10H17NO2S2/c11-9(12)13-6-8-7-14-10(15-8)4-2-1-3-5-10/h8H,1-7H2,(H2,11,12)
InChIKey
XGIRBWKKCPENLG-UHFFFAOYSA-N
Compound name
1,4-dithiaspiro[4.5]decan-3-ylmethyl carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.07007 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.07735 151.2
[M+Na]+ 270.05929 157.1
[M+NH4]+ 265.10389 161.5
[M+K]+ 286.03323 148.6
[M-H]- 246.06279 153.5
[M+Na-2H]- 268.04474 155.1
[M]+ 247.06952 153.4
[M]- 247.07062 153.4
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.