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

38
Patents

274.13174 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.139016 165.1
[M+Na]+ 297.120958 171.8
[M-H]- 273.124464 167.9
[M+NH4]+ 292.165563 176.9
[M+K]+ 313.094898 171.5
[M+H-H2O]+ 257.129000 154.3
[M+HCOO]- 319.129941 179.3
[M+CH3COO]- 333.145591 197.0
[M+Na-2H]- 295.106406 168.7
[M]+ 274.13119142 173.5
[M]- 274.13228858 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