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3-(4-Methoxyphenyl)-3a,7a-dimethyl-3,3a,7,7a-tetrahydro-2H-pyrano[2,3-d]oxazol-2-one
SpectraBase Compound ID 89jJ083kLjK
InChI InChI=1S/C15H17NO4/c1-14-9-4-10-19-15(14,2)16(13(17)20-14)11-5-7-12(18-3)8-6-11/h4-8,10H,9H2,1-3H3
InChIKey LMDOJUDKULSHRV-UHFFFAOYSA-N
Mol Weight 275.3 g/mol
Molecular Formula C15H17NO4
Exact Mass 275.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5EByLNfzfM
Name 3-(4-Methoxyphenyl)-3a,7a-dimethyl-3,3a,7,7a-tetrahydro-2H-pyrano[2,3-d]oxazol-2-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 275.115758027 u
Formula C15H17NO4
InChI InChI=1S/C15H17NO4/c1-14-9-4-10-19-15(14,2)16(13(17)20-14)11-5-7-12(18-3)8-6-11/h4-8,10H,9H2,1-3H3
InChIKey LMDOJUDKULSHRV-UHFFFAOYSA-N
Instrument Name Thermo Polaris Q-Trace GC Ultra or Hewlett-Packard 5971A
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200364
Quality 154
Reported Formula C15H17NO4
SMILES COC1=CC=C(C=C1)N1C(OC2(C1(OC=CC2)C)C)=O
SPLASH splash10-01ot-0950000000-bce7f858cbd5ce947f4a
Source of Spectrum K1-2022-SM6-18e (DOI: 10.1002/ejoc.202200364)
Thin-Layer Chromatography 0.33 (hexane/EtOAc, 7:3)
Wiley ID 1898662