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[15-13C]-3,4-Dihydro-epi-deoxy-5-oxoarteannuin B
SpectraBase Compound ID Fn2ZZIksJ5r
InChI InChI=1S/C15H20O3/c1-8-4-7-12-10(3)14(17)18-15(12)11(8)6-5-9(2)13(15)16/h5,8,10-12H,4,6-7H2,1-3H3/t8-,10-,11+,12+,15+/m1/s1/i2+1
InChIKey LGPCPOMNWADNMH-MAAZWQJBSA-N
Mol Weight 249.31 g/mol
Molecular Formula C1413CH20O3
Exact Mass 249.144599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H7t32Mkw2oC
Name [15-13C]-3,4-Dihydro-epi-deoxy-5-oxoarteannuin B
Comments Original formula: C14[13C]H20O3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-8-4-7-12-10(3)14(17)18-15(12)11(8)6-5-9(2)13(15)16/h5,8,10-12H,4,6-7H2,1-3H3/t8-,10-,11+,12+,15+/m1/s1/i2+1
InChIKey LGPCPOMNWADNMH-MAAZWQJBSA-N
Molecular Weight 249.314 g/mol
SMILES [13CH3]C=1C([C@]23OC(=O)[C@@]([C@@]3(CC[C@]([C@@]2(CC1)[H])(C)[H])[H])(C)[H])=O
SPLASH splash10-0002-0190000000-a091eee05f1b7f9bf4a1
Source of Spectrum KC-57-8508-30
Wiley ID 1626090