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Benzoic acid, 2-amino-4-methyl-3-[[2-(5-methyl-2-furanyl)-1,3-dioxolan-2-yl]methoxy]-
SpectraBase Compound ID A4pu5mAiSLh
InChI InChI=1S/C17H19NO6/c1-10-3-5-12(16(19)20)14(18)15(10)21-9-17(22-7-8-23-17)13-6-4-11(2)24-13/h3-6H,7-9,18H2,1-2H3,(H,19,20)
InChIKey GHMGTLHUSDMZNG-UHFFFAOYSA-N
Mol Weight 333.34 g/mol
Molecular Formula C17H19NO6
Exact Mass 333.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dxxpd38h7Ce
Name Benzoic acid, 2-amino-4-methyl-3-[[2-(5-methyl-2-furanyl)-1,3-dioxolan-2-yl]methoxy]-
CAS Registry Number 81805-45-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO6
InChI InChI=1S/C17H19NO6/c1-10-3-5-12(16(19)20)14(18)15(10)21-9-17(22-7-8-23-17)13-6-4-11(2)24-13/h3-6H,7-9,18H2,1-2H3,(H,19,20)
InChIKey GHMGTLHUSDMZNG-UHFFFAOYSA-N
Molecular Weight 333.340 g/mol
SMILES Nc1c(C(=O)O)ccc(c1OCC1(c2oc(C)cc2)OCCO1)C
SPLASH splash10-0uxs-3900000000-547e4a624510cf588675
Source of Spectrum B-39-661-38
Synonyms 2-Amino-4-methyl-3-[2-(5-methyl)furoyl]methoxybenzoic acid ethylene acetal 2-Amino-4-methyl-3-{[2-(5-methyl-2-furyl)-1,3-dioxolan-2-yl]methoxy}benzoic acid
Wiley ID 1330165