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1,7-Phenanthrenedicarboxylic acid, 5,6,7,8,9,10-hexahydro-7-hydroxy-2-methoxy-, 1-methyl ester, (.+-.)-
SpectraBase Compound ID HJNc85r4n2E
InChI InChI=1S/C18H20O6/c1-23-14-6-5-12-11-7-8-18(22,17(20)21)9-10(11)3-4-13(12)15(14)16(19)24-2/h5-6,22H,3-4,7-9H2,1-2H3,(H,20,21)
InChIKey BHLOGFCPJYBDKQ-UHFFFAOYSA-N
Mol Weight 332.35 g/mol
Molecular Formula C18H20O6
Exact Mass 332.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JMbTtkVq1S
Name 1,7-Phenanthrenedicarboxylic acid, 5,6,7,8,9,10-hexahydro-7-hydroxy-2-methoxy-, 1-methyl ester, (.+-.)-
CAS Registry Number 87920-69-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O6
InChI InChI=1S/C18H20O6/c1-23-14-6-5-12-11-7-8-18(22,17(20)21)9-10(11)3-4-13(12)15(14)16(19)24-2/h5-6,22H,3-4,7-9H2,1-2H3,(H,20,21)
InChIKey BHLOGFCPJYBDKQ-UHFFFAOYSA-N
Molecular Weight 332.352 g/mol
SMILES OC(C1(CC=2CCc3c(C(=O)OC)c(OC)ccc3C2CC1)O)=O
SPLASH splash10-001i-0029000000-b8fcf2391d16727c2bd3
Source of Spectrum B-36-1182-0
Synonyms 2-Hydroxy-7-methoxy-8-(methoxycarbonyl)-1,2,3,4,9,10-hexahydro-2-phenanthrenecarboxylic acid 2-Hydroxy-7-methoxy-8-methoxycarbonyl-1,2,3,4,9,10-hexahydrophenanthrene-2-carboxylic acid
Wiley ID 1329343