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4'-octylspiro[2H-1-benzopyran-2,2'-(1,3)dioxolan]
SpectraBase Compound ID 9zzZ9KuHYTX
InChI InChI=1S/C19H26O3/c1-2-3-4-5-6-7-11-17-15-20-19(21-17)14-13-16-10-8-9-12-18(16)22-19/h8-10,12-14,17H,2-7,11,15H2,1H3
InChIKey WPXNHYYNKPMSTE-UHFFFAOYSA-N
Mol Weight 302.41 g/mol
Molecular Formula C19H26O3
Exact Mass 302.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5m1aRH7rOUS
Name 4'-octylspiro[2H-1-benzopyran-2,2'-(1,3)dioxolan]
Alternate Name(s) 4'-octylspiro[chromene-2,2'-[1,3]dioxolane]
CAS Registry Number 126291-61-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O3
InChI InChI=1S/C19H26O3/c1-2-3-4-5-6-7-11-17-15-20-19(21-17)14-13-16-10-8-9-12-18(16)22-19/h8-10,12-14,17H,2-7,11,15H2,1H3
InChIKey WPXNHYYNKPMSTE-UHFFFAOYSA-N
Molecular Weight 302.414 g/mol
SMILES C12(Oc3ccccc3C=C2)OC(CCCCCCCC)CO1
SPLASH splash10-05mn-9601000000-99d7d3f84ec1715e6092
Source of Spectrum B-42-1244-7
Wiley ID 1304968