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3-epi-Perforenone A
SpectraBase Compound ID 5PlC0GlgJce
InChI InChI=1S/C15H22O2/c1-9-5-6-12-10(2)13(16)14(17)11(3)15(12,4)8-7-9/h7,11,14,17H,5-6,8H2,1-4H3/t11-,14+,15+/m0/s1
InChIKey FUPXAIKSURJKNB-NILFDRSVSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Htjbw1LZ5M
Name 3-epi-Perforenone A
Appearance oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-9-5-6-12-10(2)13(16)14(17)11(3)15(12,4)8-7-9/h7,11,14,17H,5-6,8H2,1-4H3/t11-,14+,15+/m0/s1
InChIKey FUPXAIKSURJKNB-NILFDRSVSA-N
Ionization Type EI
Literature Reference DOI 10.1021/np020274v
Molecular Weight 234.339 g/mol
Optical Rotation [a]D22 = -24.0 (c = 0.1, CHCl3)
Reported Formula C15H22O2
SMILES O[C@]1(C(C(=C2[C@@]([C@]1(C)[H])(CC=C(CC2)C)C)C)=O)[H]
SPLASH splash10-0079-0920000000-b6c89912b3c8ed45fd94
Source of Spectrum G4-66-437-3
Wiley ID 1881252