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7,8-Isoquinolinediol, 3-(6-ethenyl-4-methyl-1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydro-2-methyl-
SpectraBase Compound ID FKbWKDPJIbf
InChI InChI=1S/C20H21NO4/c1-4-12-8-17-20(25-10-24-17)11(2)18(12)15-7-13-5-6-16(22)19(23)14(13)9-21(15)3/h4-6,8,15,22-23H,1,7,9-10H2,2-3H3
InChIKey UCGNVPDCDDTAID-UHFFFAOYSA-N
Mol Weight 339.39 g/mol
Molecular Formula C20H21NO4
Exact Mass 339.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BHZqELbOsuS
Name 7,8-Isoquinolinediol, 3-(6-ethenyl-4-methyl-1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydro-2-methyl-
CAS Registry Number 55299-21-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO4
InChI InChI=1S/C20H21NO4/c1-4-12-8-17-20(25-10-24-17)11(2)18(12)15-7-13-5-6-16(22)19(23)14(13)9-21(15)3/h4-6,8,15,22-23H,1,7,9-10H2,2-3H3
InChIKey UCGNVPDCDDTAID-UHFFFAOYSA-N
Molecular Weight 339.391 g/mol
SMILES Oc1c2CN(C(Cc2ccc1O)c1c(C)c2c(cc1C=C)OCO2)C
SPLASH splash10-000l-1915000000-1a8aa9c8d74f69633d7e
Source of Spectrum O-3-142-1
Synonyms 2-Methyl-3-(4-methyl-6-vinyl-1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydro-7,8-isoquinolinediol 2-Methyl-3-(4-methyl-6-vinyl-1,3-benzodioxol-5-yl)-3,4-dihydro-1H-isoquinoline-7,8-diol 3-(6-Ethenyl-4-methyl-1,3-benzodioxol-5-yl)-2-methyl-3,4-dihydro-1H-isoquinoline-7,8-diol
Wiley ID 50578