CID 165737904

2803862-38-4

Structural Information

Molecular Formula
C11H19NO2S
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CC(C2)S
InChI
InChI=1S/C11H19NO2S/c1-10(2,3)14-9(13)12-6-11(7-12)4-8(15)5-11/h8,15H,4-7H2,1-3H3
InChIKey
TVIWWZXARUJJFG-UHFFFAOYSA-N
Compound name
tert-butyl 6-sulfanyl-2-azaspiro[3.3]heptane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.11365 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.12093 151.5
[M+Na]+ 252.10287 151.2
[M+NH4]+ 247.14747 152.4
[M+K]+ 268.07681 148.3
[M-H]- 228.10637 146.6
[M+Na-2H]- 250.08832 150.8
[M]+ 229.11310 148.3
[M]- 229.11420 148.3
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.