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4-(Methoxymethoxy)methyl-2-[(3'E)-2-hydroxy-hept-3'-en-5'-yn-1'-yl]-1,3-oxazole
SpectraBase Compound ID AjpHyxOuQja
InChI InChI=1S/C13H17NO4/c1-3-4-5-6-12(15)7-13-14-11(9-18-13)8-17-10-16-2/h5-6,9,12,15H,7-8,10H2,1-2H3/b6-5+
InChIKey QECJQYYGOVFDQD-AATRIKPKSA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ouE8X7GKe8
Name 4-(Methoxymethoxy)methyl-2-[(3'E)-2-hydroxy-hept-3'-en-5'-yn-1'-yl]-1,3-oxazole
Alternate Name(s) (E)-1-(4-((methoxymethoxy)methyl)oxazol-2-yl)hept-3-en-5-yn-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-3-4-5-6-12(15)7-13-14-11(9-18-13)8-17-10-16-2/h5-6,9,12,15H,7-8,10H2,1-2H3/b6-5+
InChIKey QECJQYYGOVFDQD-AATRIKPKSA-N
Literature Reference DOI 10.1002/anie.201501922
Molecular Weight 251.282 g/mol
SMILES OC(Cc1occ(COCOC)n1)\C=C\C#CC
SPLASH splash10-054k-7910000000-cc5186a1824627ad7a84
Source of Spectrum ACI-54-7086/SMS2-8
Wiley ID 1761227