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TARAXEROL;REFERENCES
SpectraBase Compound ID 7DF1R0GagOQ
InChI InChI=1S/C30H50O/c1-25(2)17-18-27(5)13-9-21-29(7)14-10-20-26(3,4)24(31)12-16-28(20,6)22(29)11-15-30(21,8)23(27)19-25/h9,20,22-24,31H,10-19H2,1-8H3/t20-,22+,23+,24-,27-,28-,29-,30+/m0/s1
InChIKey GGGUGZHBAOMSFJ-GADYQYKKSA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C4m3MbmKcy8
Name Taraxerol
Carrier Gas Nitrogen (2 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O
GC Oven Program Oven temp 200oC
InChI InChI=1S/C30H50O/c1-25(2)17-18-27(5)13-9-21-29(7)14-10-20-26(3,4)24(31)12-16-28(20,6)22(29)11-15-30(21,8)23(27)19-25/h9,20,22-24,31H,10-19H2,1-8H3/t20-,22+,23+,24-,27-,28-,29-,30+/m0/s1
InChIKey GGGUGZHBAOMSFJ-GADYQYKKSA-N
Instrument Name Fisons GC 8000-MD 800
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/jssc.200600253
Molecular Weight 426.729 g/mol
Quality 594
SMILES O[C@]1(CC[C@]2([C@](C1(C)C)(CC[C@@]1([C@@]2(CC[C@@]2(C1=CC[C@@]1([C@]2(CC(CC1)(C)C)[H])C)C)[H])C)[H])C)[H]
SPLASH splash10-100u-9640000000-b33cfbc59f5a27ce480d
Source of Spectrum SEP-30-750-Taraxerol (DOI: 10.1002/jssc.200600253)
Wiley ID 1907945