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Verrucosan-2-ol
SpectraBase Compound ID K2BjcOggChH
InChI InChI=1S/C20H34O/c1-12(2)14-6-7-18(3)8-9-19(4)10-13-11-20(13,5)17(21)16(19)15(14)18/h12-17,21H,6-11H2,1-5H3/t13-,14-,15+,16-,17-,18+,19-,20+/m0/s1
InChIKey QQHDEGUZXBOWLH-HXCJBJRFSA-N
Mol Weight 290.5 g/mol
Molecular Formula C20H34O
Exact Mass 290.260966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9x3a0umFDJy
Name Verrucosane-2.beta.-ol
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.260965714 u
Formula C20H34O
GC Oven Program Oven temp 225oC
InChI InChI=1S/C20H34O/c1-12(2)14-6-7-18(3)8-9-19(4)10-13-11-20(13,5)17(21)16(19)15(14)18/h12-17,21H,6-11H2,1-5H3/t13-,14-,15+,16-,17-,18+,19-,20+/m0/s1
InChIKey QQHDEGUZXBOWLH-HXCJBJRFSA-N
Instrument Name SHIMADZU GCMS-QP2010 Ultra
Ionization Type EI
Literature Reference DOI 10.1002/anie.201700565
Molecular Weight 290.491 g/mol
Quality 929
SMILES O[C@@]1([C@]2([C@@](C[C@]3([C@]1([C@@]1([C@@](CC3)(CC[C@]1(C(C)C)[H])C)[H])[H])C)(C2)[H])C)[H]
SPLASH splash10-05fu-8910000000-553b5b46d431e055fc15
Source of Spectrum ACI-56-SM30-9 (DOI: 10.1002/anie.201700565)
Thin-Layer Chromatography 0.3 (hexane/ethyl acetate, 10:1)
Wiley ID 1895820