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1-(3,4-Methylenedioxyphenyl)-1,2-propandiol-acetonid
SpectraBase Compound ID DZbnJwNKeLs
InChI InChI=1S/C13H16O4/c1-8-12(17-13(2,3)16-8)9-4-5-10-11(6-9)15-7-14-10/h4-6,8,12H,7H2,1-3H3
InChIKey RLUYGSZYLMWYOB-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dk2HQHnFcGG
Name 1-(3,4-Methylenedioxyphenyl)-1,2-propandiol-acetonid
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 236.104858991 u
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-8-12(17-13(2,3)16-8)9-4-5-10-11(6-9)15-7-14-10/h4-6,8,12H,7H2,1-3H3
InChIKey RLUYGSZYLMWYOB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 236.267 g/mol
Nominal Mass 236 u
Quality 928
Retention Index 1779
SMILES C1(C=2C=C3C(=CC2)OCO3)C(OC(O1)(C)C)C
SPLASH splash10-055o-9810000000-67c64ba54ca3befd878f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 5-(2,2,5-trimethyl-1,3-dioxolan-4-yl)-1,3-benzodioxole
Technique GC/MS
Wiley ID DD2024_014295