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4-(Heptadec-8'-enyl)-2,2-dimethyl-1,3-benzodioxole
SpectraBase Compound ID AJMfFrJFHfn
InChI InChI=1S/C26H42O2/c1-5-7-9-11-12-14-16-19-22(18-15-13-10-8-6-2)23-20-17-21-24-25(23)28-26(3,4)27-24/h17,19-21H,5-16,18H2,1-4H3/b22-19+
InChIKey UNAKJNRICPCWFZ-ZBJSNUHESA-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 BESjU2xD8fT
Name 4-(Heptadec-8'-enyl)-2,2-dimethyl-1,3-benzodioxole
Alternate Name(s) 4-[(1E)-1-heptyl-1-decenyl]-2,2-dimethyl-1,3-benzodioxole
CAS Registry Number 122850-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H42O2
InChI InChI=1S/C26H42O2/c1-5-7-9-11-12-14-16-19-22(18-15-13-10-8-6-2)23-20-17-21-24-25(23)28-26(3,4)27-24/h17,19-21H,5-16,18H2,1-4H3/b22-19+
InChIKey UNAKJNRICPCWFZ-ZBJSNUHESA-N
Molecular Weight 386.620 g/mol
SMILES c12OC(C)(C)Oc2cccc1\C(=C\CCCCCCCC)CCCCCCC
SPLASH splash10-022i-0905000000-556257608baddf942ffe
Source of Spectrum KC-1989-436-37
Wiley ID 1362959