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Annularin C
SpectraBase Compound ID 7pf2xFnGvsh
InChI InChI=1S/C10H14O5/c1-3-7(12)10-6(5-11)8(14-2)4-9(13)15-10/h4,7,11-12H,3,5H2,1-2H3/t7-/m0/s1
InChIKey JVACJZGMLHSRGA-ZETCQYMHSA-N
Mol Weight 214.22 g/mol
Molecular Formula C10H14O5
Exact Mass 214.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2SLafgJuDXw
Name Annularin C
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O5
InChI InChI=1S/C10H14O5/c1-3-7(12)10-6(5-11)8(14-2)4-9(13)15-10/h4,7,11-12H,3,5H2,1-2H3/t7-/m0/s1
InChIKey JVACJZGMLHSRGA-ZETCQYMHSA-N
Ionization Type EI
Literature Reference DOI 10.1021/np030225y
Molecular Weight 214.217 g/mol
Optical Rotation [a]D = +10 (c = 0.2, CH2Cl2)
SMILES OCC=1C(=CC(OC1[C@](CC)(O)[H])=O)OC
SPLASH splash10-0aor-0920000000-06b5e0d1581a057dc0f0
Source of Spectrum G4-66-1305-3
Wiley ID 1883892