CID 500118

Nsc648473

Structural Information

Molecular Formula
C17H17NO3
SMILES
COCOC1C(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C17H17NO3/c1-20-12-21-16-15(13-8-4-2-5-9-13)18(17(16)19)14-10-6-3-7-11-14/h2-11,15-16H,12H2,1H3
InChIKey
GFVSKQIIHDRGOK-UHFFFAOYSA-N
Compound name
3-(methoxymethoxy)-1,4-diphenylazetidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.12085 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.12813 159.6
[M+Na]+ 306.11007 166.1
[M-H]- 282.11357 167.6
[M+NH4]+ 301.15467 167.5
[M+K]+ 322.08401 165.9
[M+H-H2O]+ 266.11811 145.2
[M+HCOO]- 328.11905 180.6
[M+CH3COO]- 342.13470 203.4
[M+Na-2H]- 304.09552 163.8
[M]+ 283.12030 170.5
[M]- 283.12140 170.5
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

No patent data available for this compound.