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Benzoic acid, 3-hydroxy-5-(methylamino)-, methyl ester
SpectraBase Compound ID 1aAjuLV6Qmt
InChI InChI=1S/C9H11NO3/c1-10-7-3-6(9(12)13-2)4-8(11)5-7/h3-5,10-11H,1-2H3
InChIKey PXKDKRMXHVKOAF-UHFFFAOYSA-N
Mol Weight 181.19 g/mol
Molecular Formula C9H11NO3
Exact Mass 181.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CC7VhcftnRU
Name Benzoic acid, 3-hydroxy-5-(methylamino)-, methyl ester
CAS Registry Number 89610-99-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO3
InChI InChI=1S/C9H11NO3/c1-10-7-3-6(9(12)13-2)4-8(11)5-7/h3-5,10-11H,1-2H3
InChIKey PXKDKRMXHVKOAF-UHFFFAOYSA-N
Molecular Weight 181.191 g/mol
SMILES N(c1cc(cc(c1)O)C(=O)OC)C
SPLASH splash10-0089-0900000000-8172f9438d282c432f65
Source of Spectrum F-39-4191-0
Synonyms 3-Hydroxy-5-(methylamino)benzoic acid methyl ester Methyl 3-(methylamino)-5-oxidanyl-benzoate Methyl 3-hydroxy-5-(methylamino)benzoate
Wiley ID 1177356