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Verticillatine B
SpectraBase Compound ID Kjg4jxRjbaG
InChI InChI=1S/C13H15NO/c1-9(2)7-13(15)11-3-4-12-10(8-11)5-6-14-12/h3-6,8-9,14H,7H2,1-2H3
InChIKey DXSWZSCZKREHHH-UHFFFAOYSA-N
Mol Weight 201.27 g/mol
Molecular Formula C13H15NO
Exact Mass 201.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQGs0nsXbo5
Name Verticillatine B
Appearance White solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO
InChI InChI=1S/C13H15NO/c1-9(2)7-13(15)11-3-4-12-10(8-11)5-6-14-12/h3-6,8-9,14H,7H2,1-2H3
InChIKey DXSWZSCZKREHHH-UHFFFAOYSA-N
Instrument Name LTQ orbitrap velos/Thermo Finnigan LTQ FT/Thermo Finnigan MAT 95/Finnigan MAT 95 XLT
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.11.184
Molecular Weight 201.269 g/mol
Reported Formula C13H15NO
SMILES [nH]1ccc2c1ccc(c2)C(CC(C)C)=O
SPLASH splash10-0006-0910000000-ccdb42f506503fe5d182
Source of Spectrum BJO-11-SM16-20
Thin-Layer Chromatography Rf = 0.20 (PE/EA, 5:1)
Wiley ID 1851582