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(3-Pentyl)-3,4-methylenedioxy benzoate
SpectraBase Compound ID 9fiO5O7JvWA
InChI InChI=1S/C13H16O4/c1-3-10(4-2)17-13(14)9-5-6-11-12(7-9)16-8-15-11/h5-7,10H,3-4,8H2,1-2H3
InChIKey OMCLIOYWWLJBOE-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 JExNhNWP6Q4
Name (3-Pentyl)-3,4-methylenedioxy benzoate
Classification Designer drug side product
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 236.104858991 u
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-3-10(4-2)17-13(14)9-5-6-11-12(7-9)16-8-15-11/h5-7,10H,3-4,8H2,1-2H3
InChIKey OMCLIOYWWLJBOE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 236.267 g/mol
Nominal Mass 236 u
Quality 917
Retention Index 1729
SMILES C1=2C(=CC=C(C(OC(CC)CC)=O)C2)OCO1
SPLASH splash10-02t9-9400000000-bba51806741a1b1d9db5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Pent-3-yl-3,4-methylenedioxy benzoate 1-Ethylpropyl 3,4-methylenedioxy benzoate
Technique GC/MS
Wiley ID DD2024_014936