CID 43619968

1216033-16-7

Structural Information

Molecular Formula
C9H18N2O2S
SMILES
C1CC(C(C1)N2CCCS2(=O)=O)CN
InChI
InChI=1S/C9H18N2O2S/c10-7-8-3-1-4-9(8)11-5-2-6-14(11,12)13/h8-9H,1-7,10H2
InChIKey
JCHRCRQMNGLGDP-UHFFFAOYSA-N
Compound name
[2-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclopentyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.1089 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.11618 147.6
[M+Na]+ 241.09812 154.8
[M-H]- 217.10162 152.5
[M+NH4]+ 236.14272 170.3
[M+K]+ 257.07206 152.5
[M+H-H2O]+ 201.10616 142.4
[M+HCOO]- 263.10710 164.2
[M+CH3COO]- 277.12275 183.7
[M+Na-2H]- 239.08357 146.1
[M]+ 218.10835 144.9
[M]- 218.10945 144.9
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.