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Dolabradiene
SpectraBase Compound ID FCzH8UYru7v
InChI InChI=1S/C20H32/c1-6-18(3)12-13-20(5)16(14-18)10-11-19(4)15(2)8-7-9-17(19)20/h6,16-17H,1-2,7-14H2,3-5H3/t16?,17?,18-,19?,20+/m0/s1
InChIKey GHYZJFFJSPZRIU-AXGZHYKBSA-N
Mol Weight 272.5 g/mol
Molecular Formula C20H32
Exact Mass 272.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RifquiRgFH
Name Dolabradiene
CAS Registry Number 3650-13-3
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 272.250401030 u
Formula C20H32
InChI InChI=1S/C20H32/c1-6-18(3)12-13-20(5)16(14-18)10-11-19(4)15(2)8-7-9-17(19)20/h6,16-17H,1-2,7-14H2,3-5H3/t16?,17?,18-,19?,20+/m0/s1
InChIKey GHYZJFFJSPZRIU-AXGZHYKBSA-N
Molecular Weight 272.476 g/mol
Number of Peaks 50
RI1 1975
SMILES C1CC(C2(C(C1)[C@@]1(CC[C@@](CC1CC2)(C=C)C)C)C)=C
SPLASH splash10-0a4l-9830000000-59a51d82d3852f2f6622
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Phenanthrene, 7-ethenyltetradecahydro-4b,7,10a-trimethyl-1-methylene-
Wiley ID LM_FFNSC3_2842