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Isopropyl-3,4-methylenedioxy benzoate
SpectraBase Compound ID KxpIlu8rhg7
InChI InChI=1S/C11H12O4/c1-7(2)15-11(12)8-3-4-9-10(5-8)14-6-13-9/h3-5,7H,6H2,1-2H3
InChIKey YVDKGPTVSMEOCL-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 GUnEPCpDTX6
Name Isopropyl-3,4-methylenedioxy benzoate
Classification Designer drug side product
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 208.073558862 u
Formula C11H12O4
InChI InChI=1S/C11H12O4/c1-7(2)15-11(12)8-3-4-9-10(5-8)14-6-13-9/h3-5,7H,6H2,1-2H3
InChIKey YVDKGPTVSMEOCL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 208.213 g/mol
Nominal Mass 208 u
Quality 988
Retention Index 1539
SMILES C1=2C(=CC=C(C(OC(C)C)=O)C2)OCO1
SPLASH splash10-014i-6910000000-2d59d1b1f5fd37a8b52e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Propan-2-yl 1,3-benzodioxole-5-carboxylate
Technique GC/MS
Wiley ID DD2024_014909