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3,4-Methylenedioxyphenylacetic acid
SpectraBase Compound ID 86muWPMl6DB
InChI InChI=1S/C9H8O4/c10-9(11)4-6-1-2-7-8(3-6)13-5-12-7/h1-3H,4-5H2,(H,10,11)
InChIKey ODVLMCWNGKLROU-UHFFFAOYSA-N
Mol Weight 180.16 g/mol
Molecular Formula C9H8O4
Exact Mass 180.042259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4F5agWW6EKq
Name 3,4-Methylenedioxyphenylacetic acid
CAS Registry Number 2861-28-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8O4
InChI InChI=1S/C9H8O4/c10-9(11)4-6-1-2-7-8(3-6)13-5-12-7/h1-3H,4-5H2,(H,10,11)
InChIKey ODVLMCWNGKLROU-UHFFFAOYSA-N
Molecular Weight 180.159 g/mol
SMILES OC(Cc1cc2c(OCO2)cc1)=O
SPLASH splash10-000i-4900000000-05397764a07892ff5a31
Source of Spectrum NP-17-6562-0
Synonyms 1,3-Benzodioxol-5-ylacetic acid 1,3-Benzodioxole-5-acetic acid Homopiperonylic acid 2-(1,3-benzodioxol-5-yl)acetic acid
Wiley ID 1101990