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4-(1,3-benzodioxol-4-yl)butanoic acid

View entire compound with spectra: 1 MS (GC)

4-(1,3-benzodioxol-4-yl)butanoic acid
SpectraBase Compound ID 7uupPa2tzmP
InChI InChI=1S/C11H12O4/c12-10(13)6-2-4-8-3-1-5-9-11(8)15-7-14-9/h1,3,5H,2,4,6-7H2,(H,12,13)
InChIKey LQOVFVGJOQVSNS-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 Ik69Rmbl5cK
Name 4-(1,3-benzodioxol-4-yl)butanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O4
InChI InChI=1S/C11H12O4/c12-10(13)6-2-4-8-3-1-5-9-11(8)15-7-14-9/h1,3,5H,2,4,6-7H2,(H,12,13)
InChIKey LQOVFVGJOQVSNS-UHFFFAOYSA-N
Molecular Weight 208.213 g/mol
SMILES OC(CCCc1c2OCOc2ccc1)=O
SPLASH splash10-054k-8930000000-736c1256d1fb7a1284e2
Source of Spectrum MZ-34-3758-5
Synonyms 4-(1,3-benzodioxol-4-yl)butyric acid
Wiley ID 1582639