CID 61798544

Propan-2-yl 3-hydroxypiperidine-1-carboxylate

Structural Information

Molecular Formula
C9H17NO3
SMILES
CC(C)OC(=O)N1CCCC(C1)O
InChI
InChI=1S/C9H17NO3/c1-7(2)13-9(12)10-5-3-4-8(11)6-10/h7-8,11H,3-6H2,1-2H3
InChIKey
GCHHDBCXGJEKER-UHFFFAOYSA-N
Compound name
propan-2-yl 3-hydroxypiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.12085 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.12813 142.8
[M+Na]+ 210.11007 147.5
[M-H]- 186.11357 142.9
[M+NH4]+ 205.15467 160.4
[M+K]+ 226.08401 147.2
[M+H-H2O]+ 170.11811 136.6
[M+HCOO]- 232.11905 159.1
[M+CH3COO]- 246.13470 179.2
[M+Na-2H]- 208.09552 144.4
[M]+ 187.12030 139.7
[M]- 187.12140 139.7
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.