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(E)-1-(4-(3-butoxyphenyl)but-3-en-1-yl)-2-isobutyl-4-methylbenzene
SpectraBase Compound ID 9OI4Eux7dKR
InChI InChI=1S/C25H34O/c1-5-6-16-26-25-13-9-11-22(19-25)10-7-8-12-23-15-14-21(4)18-24(23)17-20(2)3/h7,9-11,13-15,18-20H,5-6,8,12,16-17H2,1-4H3/b10-7+
InChIKey SFSXGGMNFUGTRR-JXMROGBWSA-N
Mol Weight 350.5 g/mol
Molecular Formula C25H34O
Exact Mass 350.260966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AE5nUTUv3Dv
Name (E)-1-(4-(3-butoxyphenyl)but-3-en-1-yl)-2-isobutyl-4-methylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34O
InChI InChI=1S/C25H34O/c1-5-6-16-26-25-13-9-11-22(19-25)10-7-8-12-23-15-14-21(4)18-24(23)17-20(2)3/h7,9-11,13-15,18-20H,5-6,8,12,16-17H2,1-4H3/b10-7+
InChIKey SFSXGGMNFUGTRR-JXMROGBWSA-N
Ionization Type EI
Molecular Weight 350.546 g/mol
SMILES C(CCC)Oc1cc(ccc1)\C=C\CCc1c(cc(cc1)C)CC(C)C
SPLASH splash10-02t9-0900000000-2f06523f0e59e3bee975
Sample Comments Isomer 3
Source of Spectrum WO2020089274A1
Wiley ID 1877316