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2-(3-Methyl-2H-1,4-benzodioxin-3-yl)acetic acid ethyl ester
SpectraBase Compound ID FOpLNGaaD0m
InChI InChI=1S/C13H16O4/c1-3-15-12(14)8-13(2)9-16-10-6-4-5-7-11(10)17-13/h4-7H,3,8-9H2,1-2H3
InChIKey RKPISMUKWAOQAY-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 9RQpXqLoSVC
Name 2-(3-Methyl-2H-1,4-benzodioxin-3-yl)acetic acid ethyl ester
CAS Registry Number 51263-61-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-3-15-12(14)8-13(2)9-16-10-6-4-5-7-11(10)17-13/h4-7H,3,8-9H2,1-2H3
InChIKey RKPISMUKWAOQAY-UHFFFAOYSA-N
Molecular Weight 236.267 g/mol
SMILES C1(Oc2c(OC1)cccc2)(CC(=O)OCC)C
SPLASH splash10-006t-8920000000-88eb43d09e898e1afd11
Source of Spectrum Y-15-778-2
Synonyms Ethyl 2-(3-methyl-2H-1,4-benzodioxin-3-yl)acetate Ethyl 2-(3-methyl-2H-1,4-benzodioxin-3-yl)ethanoate
Wiley ID 1238040