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Heliotropine propylene glycol acetal

View entire compound with spectra: 3 MS (GC)

Heliotropine propylene glycol acetal
SpectraBase Compound ID 8G8Ec89dauj
InChI InChI=1S/C11H12O4/c1-7-5-12-11(15-7)8-2-3-9-10(4-8)14-6-13-9/h2-4,7,11H,5-6H2,1H3
InChIKey HXNSADTWQWLFCB-UHFFFAOYSA-N
Mol Weight 208.21 g/mol
Molecular Formula C11H12O4
Exact Mass 208.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5UaUQPFDCRj
Name Heliotropine propylene glycol acetal
CAS Registry Number 61683-99-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O4
InChI InChI=1S/C11H12O4/c1-7-5-12-11(15-7)8-2-3-9-10(4-8)14-6-13-9/h2-4,7,11H,5-6H2,1H3
InChIKey HXNSADTWQWLFCB-UHFFFAOYSA-N
Molecular Weight 208.213 g/mol
SMILES CC1COC(c2ccc3c(c2)OCO3)O1
SPLASH splash10-05g1-1920000000-e97b7c119a66d1b3e444
Source of Spectrum MG-569-0-0
Synonyms 1,3-Benzodioxole, 5-(4-methyl-1,3-dioxolan-2-yl)- 5-(4-Methyl-1,3-dioxolan-2-yl)-1,3-benzodioxole
Wiley ID 1206535