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

*Links on SpectraBase are not permalinks.

Methyl (1R*,3R*,3aR*)-5,5-ethylenedioxy-3-hydroxy-3a-(3'-methylbut-2'-enyl)-2,3,3a,4,5,6-hexahydro-1H-indene-1-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl (1R*,3R*,3aR*)-5,5-ethylenedioxy-3-hydroxy-3a-(3'-methylbut-2'-enyl)-2,3,3a,4,5,6-hexahydro-1H-indene-1-carboxylate
SpectraBase Compound ID L3ibFSgwJGD
InChI InChI=1S/C18H26O5/c1-12(2)4-6-17-11-18(22-8-9-23-18)7-5-14(17)13(10-15(17)19)16(20)21-3/h4-5,13,15,19H,6-11H2,1-3H3/t13-,15-,17-/m1/s1
InChIKey KQONSFRXKZHIRK-FRFSOERESA-N
Mol Weight 322.4 g/mol
Molecular Formula C18H26O5
Exact Mass 322.178024 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 2FOLiqWCie
Name Methyl (1R*,3R*,3aR*)-5,5-ethylenedioxy-3-hydroxy-3a-(3'-methylbut-2'-enyl)-2,3,3a,4,5,6-hexahydro-1H-indene-1-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O5
InChI InChI=1S/C18H26O5/c1-12(2)4-6-17-11-18(22-8-9-23-18)7-5-14(17)13(10-15(17)19)16(20)21-3/h4-5,13,15,19H,6-11H2,1-3H3/t13-,15-,17-/m1/s1
InChIKey KQONSFRXKZHIRK-FRFSOERESA-N
Molecular Weight 322.401 g/mol
SMILES O[C@]1([C@]2(C([C@](C(=O)OC)(C1)[H])=CCC1(C2)OCCO1)CC=C(C)C)[H]
SPLASH splash10-0f79-8397000000-a6033550ff945f39d9c1
Source of Spectrum B-45-227-0
Synonyms Methyl (1'R,3'R,3'aR)-3'-hydroxy-3'a-(3-methylbut-2-en-1-yl)-1',2',3',3'a,4',6'-hexahydrospiro[1,3-dioxolane-2,5'-indene]-1'-carboxylate
Wiley ID 1321719