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5-(Heptadec-8'-enyl)-2,2-dimethyl-1,3-benzodioxole
SpectraBase Compound ID FcDViUpr7BK
InChI InChI=1S/C26H42O2/c1-5-7-9-11-12-14-16-18-22(17-15-13-10-8-6-2)23-19-20-24-25(21-23)28-26(3,4)27-24/h18-21H,5-17H2,1-4H3/b22-18+
InChIKey XTPFXYBWIOGDMN-RELWKKBWSA-N
Mol Weight 386.6 g/mol
Molecular Formula C26H42O2
Exact Mass 386.318481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7z2IJOe3hTI
Name 5-(Heptadec-8'-enyl)-2,2-dimethyl-1,3-benzodioxole
Alternate Name(s) 5-[(1E)-1-heptyl-1-decenyl]-2,2-dimethyl-1,3-benzodioxole
CAS Registry Number 122850-25-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H42O2
InChI InChI=1S/C26H42O2/c1-5-7-9-11-12-14-16-18-22(17-15-13-10-8-6-2)23-19-20-24-25(21-23)28-26(3,4)27-24/h18-21H,5-17H2,1-4H3/b22-18+
InChIKey XTPFXYBWIOGDMN-RELWKKBWSA-N
Molecular Weight 386.620 g/mol
SMILES C1(Oc2cc(\C(=C\CCCCCCCC)CCCCCCC)ccc2O1)(C)C
SPLASH splash10-03k9-0903000000-43b18ac87b6dbb265c51
Source of Spectrum KC-1989-437-46
Wiley ID 1362960