CID 165991240

Tert-butyl 4-[methyl(prop-2-yn-1-yl)amino]piperidine-1-carboxylate

Structural Information

Molecular Formula
C14H24N2O2
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)N(C)CC#C
InChI
InChI=1S/C14H24N2O2/c1-6-9-15(5)12-7-10-16(11-8-12)13(17)18-14(2,3)4/h1,12H,7-11H2,2-5H3
InChIKey
YHTSMOBPRHJKOE-UHFFFAOYSA-N
Compound name
tert-butyl 4-[methyl(prop-2-ynyl)amino]piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.18378 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.19106 160.4
[M+Na]+ 275.17300 166.2
[M-H]- 251.17650 161.4
[M+NH4]+ 270.21760 174.7
[M+K]+ 291.14694 164.6
[M+H-H2O]+ 235.18104 147.5
[M+HCOO]- 297.18198 172.2
[M+CH3COO]- 311.19763 206.5
[M+Na-2H]- 273.15845 161.0
[M]+ 252.18323 154.1
[M]- 252.18433 154.1
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.