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2-[N-(2,3-Dihydroxybenzyl)amino]acetaldehyde dimethyl acetal hydrochloride
SpectraBase Compound ID 3690iJGrMqK
InChI InChI=1S/C11H17NO4/c1-15-10(16-2)7-12-6-8-4-3-5-9(13)11(8)14/h3-5,10,12-14H,6-7H2,1-2H3
InChIKey YOHYNLHBBKOQKP-UHFFFAOYSA-N
Mol Weight 227.26 g/mol
Molecular Formula C11H17NO4
Exact Mass 227.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5k166DriNSY
Name 2-[N-(2,3-Dihydroxybenzyl)amino]acetaldehyde dimethyl acetal hydrochloride
Comments Computed using HOSE algorithm
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Exact Mass 227.115758027 u
Formula C11H17NO4
InChI InChI=1S/C11H17NO4/c1-15-10(16-2)7-12-6-8-4-3-5-9(13)11(8)14/h3-5,10,12-14H,6-7H2,1-2H3
InChIKey YOHYNLHBBKOQKP-UHFFFAOYSA-N
Molecular Weight 227.260 g/mol
SMILES C=1(C(CNCC(OC)OC)=CC=CC1O)O