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2,3,4,5-Tetrahydro-4-methoxy-2,4-dimethyl-1H-2-benzazepine-1,5-dione

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2,3,4,5-Tetrahydro-4-methoxy-2,4-dimethyl-1H-2-benzazepine-1,5-dione
SpectraBase Compound ID 63DrPrJPDl3
InChI InChI=1S/C13H15NO3/c1-13(17-3)8-14(2)12(16)10-7-5-4-6-9(10)11(13)15/h4-7H,8H2,1-3H3
InChIKey BWNRPIFVTIXHOB-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 Caw04X9o2NN
Name 2,3,4,5-Tetrahydro-4-methoxy-2,4-dimethyl-1H-2-benzazepine-1,5-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/c1-13(17-3)8-14(2)12(16)10-7-5-4-6-9(10)11(13)15/h4-7H,8H2,1-3H3
InChIKey BWNRPIFVTIXHOB-UHFFFAOYSA-N
Molecular Weight 233.267 g/mol
SMILES C1(N(CC(OC)(C)C(C=2C1=CC=CC2)=O)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973075