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(3'R,10E,14R,15Z)-14-(3,7-dimethyloctyl)-7,11,15,19,23-pentamethyl-3-methylenetetracosa-1,10,15-triene
SpectraBase Compound ID F2GSeYMjcOd
InChI InChI=1S/C40H74/c1-12-34(6)20-15-23-36(8)24-16-25-38(10)29-31-40(30-28-37(9)22-14-19-33(4)5)39(11)27-17-26-35(7)21-13-18-32(2)3/h12,25,27,32-33,35-37,40H,1,6,13-24,26,28-31H2,2-5,7-11H3/b38-25+,39-27-/t35?,36?,37-,40-/m1/s1
InChIKey BIYQGFZCASHLGM-UVPDDRDRSA-N
Mol Weight 555.0 g/mol
Molecular Formula C40H74
Exact Mass 554.579052 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DeiYAKX2uom
Name (3'R,10E,14R,15Z)-14-(3,7-dimethyloctyl)-7,11,15,19,23-pentamethyl-3-methylenetetracosa-1,10,15-triene
Alternate Name(s) Viaticene B
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H74
InChI InChI=1S/C40H74/c1-12-34(6)20-15-23-36(8)24-16-25-38(10)29-31-40(30-28-37(9)22-14-19-33(4)5)39(11)27-17-26-35(7)21-13-18-32(2)3/h12,25,27,32-33,35-37,40H,1,6,13-24,26,28-31H2,2-5,7-11H3/b38-25+,39-27-/t35?,36?,37-,40-/m1/s1
InChIKey BIYQGFZCASHLGM-UVPDDRDRSA-N
Instrument Name HP 6890-5973 or Agilent Technologies 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900224
Molecular Weight 555.032 g/mol
SMILES C(C(CCCC(CC\C=C\(CC[C@](\C(C)=C/CCC(CCCC(C)C)C)(CC[C@@](CCCC(C)C)(C)[H])[H])C)C)=C)=C
SPLASH splash10-067j-9400000000-54a40b2dd6ac8ca05643
Source of Spectrum U1-2019-SM17-5
Wiley ID 1848598