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(1R,4aR,7bS)-1-Phenoxy-1,3,4,4a,5,7b-hexahydro-6-oxa-2a,7-diaza-cyclobuta[e]inden-2-one
SpectraBase Compound ID 2I6mee70QAR
InChI InChI=1S/C14H14N2O3/c17-14-13(19-10-4-2-1-3-5-10)12-11-9(8-18-15-11)6-7-16(12)14/h1-5,9,12-13H,6-8H2/t9-,12-,13+/m0/s1
InChIKey WCZUGJKTWATXMM-TVYUQYBPSA-N
Mol Weight 258.28 g/mol
Molecular Formula C14H14N2O3
Exact Mass 258.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3AwwL5vlb3
Name (1R,4aR,7bS)-1-Phenoxy-1,3,4,4a,5,7b-hexahydro-6-oxa-2a,7-diaza-cyclobuta[e]inden-2-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O3
InChI InChI=1S/C14H14N2O3/c17-14-13(19-10-4-2-1-3-5-10)12-11-9(8-18-15-11)6-7-16(12)14/h1-5,9,12-13H,6-8H2/t9-,12-,13+/m0/s1
InChIKey WCZUGJKTWATXMM-TVYUQYBPSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0005.416
Molecular Weight 258.277 g/mol
SMILES [C@@]1([C@]2(N(C1=O)CC[C@@]1([H])CON=C21)[H])(Oc1ccccc1)[H]
SPLASH splash10-0032-3900000000-9464884dd9f8673c5916
Source of Spectrum ARK-2004-148-(-)-9b
Wiley ID 1875976