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4,4,6-Trimethyl-2-(4-morpholino)-7-oxabicyclo[4.1.0]hept-2-ene
SpectraBase Compound ID KyHooADO80b
InChI InChI=1S/C13H21NO2/c1-12(2)8-10(11-13(3,9-12)16-11)14-4-6-15-7-5-14/h8,11H,4-7,9H2,1-3H3
InChIKey YAPFVXXELFWHBT-UHFFFAOYSA-N
Mol Weight 223.32 g/mol
Molecular Formula C13H21NO2
Exact Mass 223.157229 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9SWCwSf3wQW
Name 4,4,6-Trimethyl-2-(4-morpholino)-7-oxabicyclo[4.1.0]hept-2-ene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 223.157228918 u
Formula C13H21NO2
InChI InChI=1S/C13H21NO2/c1-12(2)8-10(11-13(3,9-12)16-11)14-4-6-15-7-5-14/h8,11H,4-7,9H2,1-3H3
InChIKey YAPFVXXELFWHBT-UHFFFAOYSA-N
Molecular Weight 223.316 g/mol
SMILES C1COCCN1C=1C2C(CC(C1)(C)C)(C)O2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.961498