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Geranyl heptadecanoate
SpectraBase Compound ID Cd9h3ZLOAYR
InChI InChI=1S/C27H50O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-27(28)29-24-23-26(4)21-19-20-25(2)3/h20,23H,5-19,21-22,24H2,1-4H3/b26-23+
InChIKey PPYISUCELPYJHW-WNAAXNPUSA-N
Mol Weight 406.7 g/mol
Molecular Formula C27H50O2
Exact Mass 406.381081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GNTAZfUmQq
Name Geranyl heptadecanoate
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H50O2
GC Oven Program Oven temp 290oC, split/splitless injector
InChI InChI=1S/C27H50O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-27(28)29-24-23-26(4)21-19-20-25(2)3/h20,23H,5-19,21-22,24H2,1-4H3/b26-23+
InChIKey PPYISUCELPYJHW-WNAAXNPUSA-N
Instrument Name Agilent GC 7890A-inert MSD 5975C
Ionization Type EI
Literature Reference DOI 10.1002/ffj.3692
Molecular Weight 406.695 g/mol
SMILES C(C)(=CCC\C(=C\COC(=O)CCCCCCCCCCCCCCCC)C)C
SPLASH splash10-00kf-9100000000-338514a28f1fa4de24a1
Source of Spectrum FF-37-SM3-3-1
Wiley ID 1876251