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

*Links on SpectraBase are not permalinks.
1,1-(Ethylenedioxy)-3-hydroxy-5-(methoxymethyl)-5-methylcycloheptane
SpectraBase Compound ID KoEMt0QelMx
InChI InChI=1S/C12H22O4/c1-11(9-14-2)3-4-12(8-10(13)7-11)15-5-6-16-12/h10,13H,3-9H2,1-2H3
InChIKey BZUMIVNWLDZJJO-UHFFFAOYSA-N
Mol Weight 230.3 g/mol
Molecular Formula C12H22O4
Exact Mass 230.151809 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 Dss8R2yPfD
Name 1,1-(Ethylenedioxy)-3-hydroxy-5-(methoxymethyl)-5-methylcycloheptane
CAS Registry Number 80721-99-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O4
InChI InChI=1S/C12H22O4/c1-11(9-14-2)3-4-12(8-10(13)7-11)15-5-6-16-12/h10,13H,3-9H2,1-2H3
InChIKey BZUMIVNWLDZJJO-UHFFFAOYSA-N
Molecular Weight 230.304 g/mol
SMILES OC1CC2(OCCO2)CCC(COC)(C)C1
SPLASH splash10-014j-6900000000-0bd21c1dc066cd522107
Source of Spectrum J-47-1390-0
Synonyms 9-(methoxymethyl)-9-methyl-1,4-dioxaspiro[4.6]undecan-7-ol
Wiley ID 1231639