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1-Morpholin-4-yl-3-phenyl-propan-1,3-dione

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1-Morpholin-4-yl-3-phenyl-propan-1,3-dione
SpectraBase Compound ID 42G7tHOcWEE
InChI InChI=1S/C13H15NO3/c15-12(11-4-2-1-3-5-11)10-13(16)14-6-8-17-9-7-14/h1-5H,6-10H2
InChIKey DMGKBMKCTCEHQQ-UHFFFAOYSA-N
Mol Weight 233.27 g/mol
Molecular Formula C13H15NO3
Exact Mass 233.105193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 97Vp9w040lk
Name 1-Morpholin-4-yl-3-phenyl-propan-1,3-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 233.105193344 u
Formula C13H15NO3
InChI InChI=1S/C13H15NO3/c15-12(11-4-2-1-3-5-11)10-13(16)14-6-8-17-9-7-14/h1-5H,6-10H2
InChIKey DMGKBMKCTCEHQQ-UHFFFAOYSA-N
Molecular Weight 233.267 g/mol
SMILES C(CC(N1CCOCC1)=O)(C1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934079