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4-Hydroxy-3-methoxy-4-(N-methyl-2-pyrrolyl)-2-phenylcyclobutenone
SpectraBase Compound ID IaRhW2f8POz
InChI InChI=1S/C16H15NO3/c1-17-10-6-9-12(17)16(19)14(18)13(15(16)20-2)11-7-4-3-5-8-11/h3-10,19H,1-2H3
InChIKey PQKQVFVFGJNXSQ-UHFFFAOYSA-N
Mol Weight 269.3 g/mol
Molecular Formula C16H15NO3
Exact Mass 269.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UhGbUWruDt
Name 4-Hydroxy-3-methoxy-4-(N-methyl-2-pyrrolyl)-2-phenylcyclobutenone
CAS Registry Number 112597-36-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO3
InChI InChI=1S/C16H15NO3/c1-17-10-6-9-12(17)16(19)14(18)13(15(16)20-2)11-7-4-3-5-8-11/h3-10,19H,1-2H3
InChIKey PQKQVFVFGJNXSQ-UHFFFAOYSA-N
Molecular Weight 269.300 g/mol
SMILES OC1(C(OC)=C(C1=O)c1ccccc1)c1[n](ccc1)C
SPLASH splash10-066r-0490000000-f8c6a73442e9cecff761
Source of Spectrum J-53-1000-1
Synonyms 4-Hydroxy-3-methoxy-4-(1-methyl-1H-pyrrol-2-yl)-2-phenyl-2-cyclobuten-1-one
Wiley ID 1273301