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Methyl 4-(1,3-dioxan-2-yl)benzoate
SpectraBase Compound ID 4RxEDcuJPht
InChI InChI=1S/C12H14O4/c1-14-11(13)9-3-5-10(6-4-9)12-15-7-2-8-16-12/h3-6,12H,2,7-8H2,1H3
InChIKey KMFDOQIVXCQKPY-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1eQsipSuENW
Name Methyl 4-(1,3-dioxan-2-yl)benzoate
CAS Registry Number 135655-75-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-14-11(13)9-3-5-10(6-4-9)12-15-7-2-8-16-12/h3-6,12H,2,7-8H2,1H3
InChIKey KMFDOQIVXCQKPY-UHFFFAOYSA-N
Molecular Weight 222.240 g/mol
SMILES C(c1ccc(C2OCCCO2)cc1)(=O)OC
SPLASH splash10-08gi-7910000000-b5f6707d46e3595379ac
Source of Spectrum AD-0-2532-0
Synonyms 4-(1,3-dioxan-2-yl)benzoic acid methyl ester Benzoic acid, 4-(1,3-dioxan-2-yl)-, methyl ester
Wiley ID 1433515