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

*Links on SpectraBase are not permalinks.
4H-1,3-Benzodioxin-4-one, 2-(1,1-dimethylethyl)hexahydro-5-methyl-4a-(2-propenyl)-, [2s-(2.alpha.,4a.alpha.,5.beta.,8a.beta.)]-
SpectraBase Compound ID EZF9hVnRPT3
InChI InChI=1S/C16H26O3/c1-6-10-16-11(2)8-7-9-12(16)18-14(15(3,4)5)19-13(16)17/h6,11-12,14H,1,7-10H2,2-5H3
InChIKey MSSLKTFATXLLFP-UHFFFAOYSA-N
Mol Weight 266.38 g/mol
Molecular Formula C16H26O3
Exact Mass 266.188195 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 KEJ4dD2igMj
Name 4H-1,3-Benzodioxin-4-one, 2-(1,1-dimethylethyl)hexahydro-5-methyl-4a-(2-propenyl)-, [2s-(2.alpha.,4a.alpha.,5.beta.,8a.beta.)]-
CAS Registry Number 124899-18-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O3
InChI InChI=1S/C16H26O3/c1-6-10-16-11(2)8-7-9-12(16)18-14(15(3,4)5)19-13(16)17/h6,11-12,14H,1,7-10H2,2-5H3
InChIKey MSSLKTFATXLLFP-UHFFFAOYSA-N
Molecular Weight 266.381 g/mol
SMILES C=CCC12C(CCCC2C)OC(C(C)(C)C)OC1=O
SPLASH splash10-0012-7900000000-c1ead5f62ad73628eb56
Source of Spectrum H-72-710-16
Synonyms 4a-Allyl-2-tert-butyl-5-methylhexahydro-4H-1,3-benzodioxin-4-one 2-tert-Butyl-5-methyl-4a-prop-2-enyl-6,7,8,8a-tetrahydro-5H-benzo[d][1,3]dioxin-4-one 4a-allyl-2-tert-butyl-5-methyl-6,7,8,8a-tetrahydro-5H-benzo[d][1,3]dioxin-4-one
Wiley ID 1270369