CID 118168

34421-11-9

Structural Information

Molecular Formula
C11H17NO3
SMILES
CC1(CC(=C(C1=O)O)N2CCCCC2)O
InChI
InChI=1S/C11H17NO3/c1-11(15)7-8(9(13)10(11)14)12-5-3-2-4-6-12/h13,15H,2-7H2,1H3
InChIKey
HICPSQHUQBAFIQ-UHFFFAOYSA-N
Compound name
2,5-dihydroxy-5-methyl-3-piperidin-1-ylcyclopent-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

378
Patents

211.12085 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12813 148.1
[M+Na]+ 234.11007 157.4
[M+NH4]+ 229.15467 156.6
[M+K]+ 250.08401 152.7
[M-H]- 210.11357 149.0
[M+Na-2H]- 232.09552 152.8
[M]+ 211.12030 149.4
[M]- 211.12140 149.4
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

patents stripe