CID 40427565

849928-22-9

Structural Information

Molecular Formula
C18H23NO4
SMILES
CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)C3=CC=CC=C3O2
InChI
InChI=1S/C18H23NO4/c1-17(2,3)23-16(21)19-10-8-18(9-11-19)12-14(20)13-6-4-5-7-15(13)22-18/h4-7H,8-12H2,1-3H3
InChIKey
UBIJXGGLEBMDOG-UHFFFAOYSA-N
Compound name
tert-butyl 4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

80
Patents

317.16272 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.17000 174.3
[M+Na]+ 340.15194 185.3
[M+NH4]+ 335.19654 182.7
[M+K]+ 356.12588 178.3
[M-H]- 316.15544 177.2
[M+Na-2H]- 338.13739 179.1
[M]+ 317.16217 176.7
[M]- 317.16327 176.7
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