CID 52982946

Tert-butyl 2',4'-dihydro-1'h-spiro[piperidine-4,3'-quinoline]-1-carboxylate

Structural Information

Molecular Formula
C18H26N2O2
SMILES
CC(C)(C)OC(=O)N1CCC2(CC1)CC3=CC=CC=C3NC2
InChI
InChI=1S/C18H26N2O2/c1-17(2,3)22-16(21)20-10-8-18(9-11-20)12-14-6-4-5-7-15(14)19-13-18/h4-7,19H,8-13H2,1-3H3
InChIKey
WADUXZCOHAHPFB-UHFFFAOYSA-N
Compound name
tert-butyl spiro[2,4-dihydro-1H-quinoline-3,4'-piperidine]-1'-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

302.19943 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.20671 176.4
[M+Na]+ 325.18865 180.2
[M-H]- 301.19215 177.2
[M+NH4]+ 320.23325 191.0
[M+K]+ 341.16259 176.1
[M+H-H2O]+ 285.19669 167.8
[M+HCOO]- 347.19763 185.7
[M+CH3COO]- 361.21328 199.8
[M+Na-2H]- 323.17410 180.5
[M]+ 302.19888 169.8
[M]- 302.19998 169.8
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