CID 84051817

3-(pyrrolidine-1-carbonyl)piperidin-3-ol hydrochloride

Structural Information

Molecular Formula
C10H18N2O2
SMILES
C1CCN(C1)C(=O)C2(CCCNC2)O
InChI
InChI=1S/C10H18N2O2/c13-9(12-6-1-2-7-12)10(14)4-3-5-11-8-10/h11,14H,1-8H2
InChIKey
SJBZAFKTYHYPJX-UHFFFAOYSA-N
Compound name
(3-hydroxypiperidin-3-yl)-pyrrolidin-1-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.13683 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.14411 148.2
[M+Na]+ 221.12605 151.3
[M-H]- 197.12955 148.1
[M+NH4]+ 216.17065 166.2
[M+K]+ 237.09999 148.9
[M+H-H2O]+ 181.13409 140.9
[M+HCOO]- 243.13503 161.4
[M+CH3COO]- 257.15068 175.0
[M+Na-2H]- 219.11150 149.5
[M]+ 198.13628 138.5
[M]- 198.13738 138.5
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.