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3,5-diamino-o-toluic acid

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

3,5-diamino-o-toluic acid
SpectraBase Compound ID 9HIvGXD5FhR
InChI InChI=1S/C8H10N2O2/c1-4-6(8(11)12)2-5(9)3-7(4)10/h2-3H,9-10H2,1H3,(H,11,12)
InChIKey RKBQPUFPJRCJKE-UHFFFAOYSA-N
Mol Weight 166.18 g/mol
Molecular Formula C8H10N2O2
Exact Mass 166.074228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2N8rDkMy4oD
Name 3,5-Diamino-2-methylbenzoic acid
Alternate Name(s) 3,5-bis(azanyl)-2-methyl-benzoic acid
CAS Registry Number 90007-30-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10N2O2
InChI InChI=1S/C8H10N2O2/c1-4-6(8(11)12)2-5(9)3-7(4)10/h2-3H,9-10H2,1H3,(H,11,12)
InChIKey RKBQPUFPJRCJKE-UHFFFAOYSA-N
Molecular Weight 166.180 g/mol
SMILES Nc1cc(cc(c1C)C(=O)O)N
SPLASH splash10-01b9-2900000000-ba71e2690e88f810d1a7
Wiley ID 1437991