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1-(3,4,7,8-Tetrahydro-2H,6H-1-oxa-5-aza-phenanthren-5-yl)ethanone

View entire compound with spectra: 1 FTIR

1-(3,4,7,8-Tetrahydro-2H,6H-1-oxa-5-aza-phenanthren-5-yl)ethanone
SpectraBase Compound ID IMvg2odsMMZ
InChI InChI=1S/C14H17NO2/c1-10(16)15-8-2-4-11-6-7-13-12(14(11)15)5-3-9-17-13/h6-7H,2-5,8-9H2,1H3
InChIKey PMRQGOJXFINHBK-UHFFFAOYSA-N
Mol Weight 231.29 g/mol
Molecular Formula C14H17NO2
Exact Mass 231.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID iyn414GZuf
Name 1-(3,4,7,8-Tetrahydro-2H,6H-1-oxa-5-aza-phenanthren-5-yl)ethanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 231.125928789 u
Formula C14H17NO2
InChI InChI=1S/C14H17NO2/c1-10(16)15-8-2-4-11-6-7-13-12(14(11)15)5-3-9-17-13/h6-7H,2-5,8-9H2,1H3
InChIKey PMRQGOJXFINHBK-UHFFFAOYSA-N
Molecular Weight 231.295 g/mol
SMILES C1OC2=C(CC1)C1=C(C=C2)CCCN1C(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.817311