CID 68109739

Tert-butyl 4-amino-4-phenylpiperidine-1-carboxylate

Structural Information

Molecular Formula
C16H24N2O2
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)(C2=CC=CC=C2)N
InChI
InChI=1S/C16H24N2O2/c1-15(2,3)20-14(19)18-11-9-16(17,10-12-18)13-7-5-4-6-8-13/h4-8H,9-12,17H2,1-3H3
InChIKey
QNGLEJHPGWKPSB-UHFFFAOYSA-N
Compound name
tert-butyl 4-amino-4-phenylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

276.18378 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.191056 167.8
[M+Na]+ 299.172998 172.1
[M-H]- 275.176504 171.8
[M+NH4]+ 294.217603 183.8
[M+K]+ 315.146938 169.7
[M+H-H2O]+ 259.181040 160.3
[M+HCOO]- 321.181981 184.4
[M+CH3COO]- 335.197631 199.1
[M+Na-2H]- 297.158446 171.3
[M]+ 276.18323142 163.7
[M]- 276.18432858 163.7
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

patents stripe