CID 116372

64047-03-6

Structural Information

Molecular Formula
C9H15NO3
SMILES
CCCCCC1(C(=O)NC(=O)O1)C
InChI
InChI=1S/C9H15NO3/c1-3-4-5-6-9(2)7(11)10-8(12)13-9/h3-6H2,1-2H3,(H,10,11,12)
InChIKey
SHMZIDMBSDUOSR-UHFFFAOYSA-N
Compound name
5-methyl-5-pentyl-1,3-oxazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.1052 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.112476 138.4
[M+Na]+ 208.094418 146.5
[M-H]- 184.097924 140.0
[M+NH4]+ 203.139023 159.0
[M+K]+ 224.068358 145.7
[M+H-H2O]+ 168.102460 133.9
[M+HCOO]- 230.103401 158.1
[M+CH3COO]- 244.119051 178.3
[M+Na-2H]- 206.079866 142.9
[M]+ 185.10465142 139.5
[M]- 185.10574858 139.5
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.