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(2S)-abyssinone II
SpectraBase Compound ID DkNoZMfMgSb
InChI InChI=1S/C20H20O4/c1-12(2)3-4-13-9-14(5-8-17(13)22)19-11-18(23)16-7-6-15(21)10-20(16)24-19/h3,5-10,19,21-22H,4,11H2,1-2H3/t19-/m0/s1
InChIKey NLTOTZSPOYWSSP-IBGZPJMESA-N
Mol Weight 324.38 g/mol
Molecular Formula C20H20O4
Exact Mass 324.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Qsv5j4or42
Name (2S)-abyssinone II
Appearance Bright yellow powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O4
InChI InChI=1S/C20H20O4/c1-12(2)3-4-13-9-14(5-8-17(13)22)19-11-18(23)16-7-6-15(21)10-20(16)24-19/h3,5-10,19,21-22H,4,11H2,1-2H3/t19-/m0/s1
InChIKey NLTOTZSPOYWSSP-IBGZPJMESA-N
Instrument Name Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1021/np010288l
SMILES Oc1ccc([C@@]2(CC(c3c(cc(cc3)O)O2)=O)[H])cc1CC=C(C)C
SPLASH splash10-009i-0934000000-6367275fe38b0327295b
Source of Spectrum G4-64-SM1-13
Wiley ID 1882892