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6,7-Dihydroxy-1-methyl-1,2,3,4-tetrahydro-1-isoquinolinecarboxylic acid
SpectraBase Compound ID FdKavHiGxth
InChI InChI=1S/C11H13NO4/c1-11(10(15)16)7-5-9(14)8(13)4-6(7)2-3-12-11/h4-5,12-14H,2-3H2,1H3,(H,15,16)
InChIKey XHGLVMDBZZZXDP-UHFFFAOYSA-N
Mol Weight 223.23 g/mol
Molecular Formula C11H13NO4
Exact Mass 223.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKLO3ApTqhc
Name 6,7-Dihydroxy-1-methyl-1,2,3,4-tetrahydro-1-isoquinolinecarboxylic acid
CAS Registry Number 57256-34-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO4
InChI InChI=1S/C11H13NO4/c1-11(10(15)16)7-5-9(14)8(13)4-6(7)2-3-12-11/h4-5,12-14H,2-3H2,1H3,(H,15,16)
InChIKey XHGLVMDBZZZXDP-UHFFFAOYSA-N
Molecular Weight 223.228 g/mol
SMILES N1CCc2cc(c(cc2C1(C)C(O)=O)O)O
SPLASH splash10-004i-4900000000-699251eb17ae1415e8d5
Source of Spectrum NP-5-4812-0
Synonyms Isoquinoline-1-carboxylic acid, 1,2,3,4-tetrahydro-6,7-hydroxy-1-methyl- Isoquinoline-1-carboxylic acid, 1,2,3,4-tetrahydro-6,7-hydroxy-1-meyhyl- 1-Methyl-6,7-bis(oxidanyl)-3,4-dihydro-2H-isoquinoline-1-carboxylic acid
Wiley ID 1104909