CID 90102659

1251001-73-6

Structural Information

Molecular Formula
C15H18N2O3
SMILES
CC(C)(C)OC(=O)N1CC2(C1)C3=CC=CC=C3NC2=O
InChI
InChI=1S/C15H18N2O3/c1-14(2,3)20-13(19)17-8-15(9-17)10-6-4-5-7-11(10)16-12(15)18/h4-7H,8-9H2,1-3H3,(H,16,18)
InChIKey
KNXROXDVJNVTCE-UHFFFAOYSA-N
Compound name
tert-butyl 2-oxospiro[1H-indole-3,3'-azetidine]-1'-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

274.13174 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.13902 165.1
[M+Na]+ 297.12096 171.8
[M-H]- 273.12446 167.9
[M+NH4]+ 292.16556 176.9
[M+K]+ 313.09490 171.5
[M+H-H2O]+ 257.12900 154.3
[M+HCOO]- 319.12994 179.3
[M+CH3COO]- 333.14559 197.0
[M+Na-2H]- 295.10641 168.7
[M]+ 274.13119 173.5
[M]- 274.13229 173.5
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