For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(4as-5,5-(ethylendioxy)-1-[3,3-(ethylendioxy)butyl]-4,4a,5,6,7,8-hexahydro-4a-methyl-2(3H)-naphthalenone
SpectraBase Compound ID 15HM3F9Zx1
InChI InChI=1S/C19H28O5/c1-17-6-3-7-19(23-12-13-24-19)16(17)14(15(20)5-8-17)4-9-18(2)21-10-11-22-18/h3-13H2,1-2H3/t17-/m0/s1
InChIKey ZUGQRJNDLGEOLI-KRWDZBQOSA-N
Mol Weight 336.43 g/mol
Molecular Formula C19H28O5
Exact Mass 336.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 71hlcWKxqgu
Name (4as-5,5-(ethylendioxy)-1-[3,3-(ethylendioxy)butyl]-4,4a,5,6,7,8-hexahydro-4a-methyl-2(3H)-naphthalenone
CAS Registry Number 99678-61-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O5
InChI InChI=1S/C19H28O5/c1-17-6-3-7-19(23-12-13-24-19)16(17)14(15(20)5-8-17)4-9-18(2)21-10-11-22-18/h3-13H2,1-2H3/t17-/m0/s1
InChIKey ZUGQRJNDLGEOLI-KRWDZBQOSA-N
Molecular Weight 336.428 g/mol
SMILES C12=C(C(=O)CC[C@@]2(CCCC11OCCO1)C)CCC1(OCCO1)C
SPLASH splash10-000i-0019000000-0139d4dae00824641c31
Source of Spectrum K-118-4336-9
Synonyms (4'aS)-4'a-methyl-8'-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-3',4',4'a,5',6',7'-hexahydro-2'H-spiro[1,3-dioxolane-2,1'-naphthalene]-7'-one (4aS-5,5-(ethylendioxy)-1-[3,3-(ethylendioxy)butyl]-4,4a,5,6,7,8-hexahydro-4a-methyl-2(3H)-naphthalinone
Wiley ID 1332434