CID 132196253

Tert-butyl 4-(2-methyl-3-oxopropyl)piperidine-1-carboxylate

Structural Information

Molecular Formula
C14H25NO3
SMILES
CC(CC1CCN(CC1)C(=O)OC(C)(C)C)C=O
InChI
InChI=1S/C14H25NO3/c1-11(10-16)9-12-5-7-15(8-6-12)13(17)18-14(2,3)4/h10-12H,5-9H2,1-4H3
InChIKey
RWQMRQRLAHEPCM-UHFFFAOYSA-N
Compound name
tert-butyl 4-(2-methyl-3-oxopropyl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

255.18344 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.19072 162.4
[M+Na]+ 278.17266 166.2
[M-H]- 254.17616 163.4
[M+NH4]+ 273.21726 178.1
[M+K]+ 294.14660 165.5
[M+H-H2O]+ 238.18070 156.0
[M+HCOO]- 300.18164 177.2
[M+CH3COO]- 314.19729 195.7
[M+Na-2H]- 276.15811 162.9
[M]+ 255.18289 161.8
[M]- 255.18399 161.8
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