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.alpha.-Agarofuran
SpectraBase Compound ID JGtmWmoqR2k
InChI InChI=1S/C15H24O/c1-11-6-5-8-14(4)9-7-12-10-15(11,14)16-13(12,2)3/h6,12H,5,7-10H2,1-4H3/t12-,14+,15+/m1/s1
InChIKey ZLQADKTVJQXDIG-SNPRPXQTSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LvhPCoDmg45
Name .alpha.-agarofuran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O
GC Oven Program Oven temp 250oC, Split injector
InChI InChI=1S/C15H24O/c1-11-6-5-8-14(4)9-7-12-10-15(11,14)16-13(12,2)3/h6,12H,5,7-10H2,1-4H3/t12-,14+,15+/m1/s1
InChIKey ZLQADKTVJQXDIG-SNPRPXQTSA-N
Instrument Name Agilent 6890N/Agilent 5973N
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.6b01068
Molecular Weight 220.356 g/mol
SMILES C1C[C@@]2([C@@]3(C(=C1)C)C[C@@](CC2)(C(O3)(C)C)[H])C
SPLASH splash10-05ai-7920000000-aba175eff8c97940cff3
Source of Spectrum G4-80-SM123-15
Wiley ID 1882117