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cis-4-Phenyl-3-phthalimido-1-prop-2-enyl-2-azetidinone
SpectraBase Compound ID 4Amp8ezdoBc
InChI InChI=1S/C20H16N2O3/c1-2-12-21-16(13-8-4-3-5-9-13)17(20(21)25)22-18(23)14-10-6-7-11-15(14)19(22)24/h2-11,16-17H,1,12H2/t16-,17+/m1/s1
InChIKey SVRFSQBWEYLBQV-SJORKVTESA-N
Mol Weight 332.36 g/mol
Molecular Formula C20H16N2O3
Exact Mass 332.116092 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5svTwEYNud
Name cis-4-Phenyl-3-phthalimido-1-prop-2-enyl-2-azetidinone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.116092380 u
Formula C20H16N2O3
InChI InChI=1S/C20H16N2O3/c1-2-12-21-16(13-8-4-3-5-9-13)17(20(21)25)22-18(23)14-10-6-7-11-15(14)19(22)24/h2-11,16-17H,1,12H2/t16-,17+/m1/s1
InChIKey SVRFSQBWEYLBQV-SJORKVTESA-N
Molecular Weight 332.359 g/mol
SMILES [C@]1(N2C(=O)C=3C=CC=CC3C2=O)([H])[C@@](N(C1=O)CC=C)([H])C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934638