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15,15:18,18-bis(ethylenedioxy)-6,7-dimethyl-trans-nonadec-6-ene-2,10-diyne
SpectraBase Compound ID 6OTuLkKOBTr
InChI InChI=1S/C25H38O4/c1-5-6-10-13-22(2)23(3)14-11-8-7-9-12-15-25(28-20-21-29-25)17-16-24(4)26-18-19-27-24/h9-21H2,1-4H3/b23-22+
InChIKey PBYBGIQGSLXWKD-GHVJWSGMSA-N
Mol Weight 402.6 g/mol
Molecular Formula C25H38O4
Exact Mass 402.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JSLVHKNIIil
Name 15,15:18,18-bis(ethylenedioxy)-6,7-dimethyl-trans-nonadec-6-ene-2,10-diyne
Alternate Name(s) 2-(2-{2-[(8E)-8,9-dimethyl-8-tetradecene-4,12-diynyl]-1,3-dioxolan-2-yl}ethyl)-2-methyl-1,3-dioxolane
CAS Registry Number 124718-25-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H38O4
InChI InChI=1S/C25H38O4/c1-5-6-10-13-22(2)23(3)14-11-8-7-9-12-15-25(28-20-21-29-25)17-16-24(4)26-18-19-27-24/h9-21H2,1-4H3/b23-22+
InChIKey PBYBGIQGSLXWKD-GHVJWSGMSA-N
Molecular Weight 402.575 g/mol
SMILES C1(OCCO1)(CCC1(OCCO1)CCCC#CCC\C(=C\(CCC#CC)C)C)C
SPLASH splash10-000i-0900000000-2ccc4417acc856aab91d
Source of Spectrum J-55-2220-21
Wiley ID 1370568