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8-Carboxy-3-(1'-methylcyclohexen-4'-yl)-5-methoxybenzopyran
SpectraBase Compound ID Lv6Tzm6BWTl
InChI InChI=1S/C18H22O4/c1-11-3-5-12(6-4-11)13-9-15-16(21-2)8-7-14(18(19)20)17(15)22-10-13/h3,7-8,12-13H,4-6,9-10H2,1-2H3,(H,19,20)
InChIKey SUVLKVAJBZGQDH-UHFFFAOYSA-N
Mol Weight 302.37 g/mol
Molecular Formula C18H22O4
Exact Mass 302.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DCZAJeAbwzf
Name 8-Carboxy-3-(1'-methylcyclohexen-4'-yl)-5-methoxybenzopyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O4
InChI InChI=1S/C18H22O4/c1-11-3-5-12(6-4-11)13-9-15-16(21-2)8-7-14(18(19)20)17(15)22-10-13/h3,7-8,12-13H,4-6,9-10H2,1-2H3,(H,19,20)
InChIKey SUVLKVAJBZGQDH-UHFFFAOYSA-N
Molecular Weight 302.370 g/mol
SMILES OC(c1c2c(CC(CO2)C2CC=C(CC2)C)c(cc1)OC)=O
SPLASH splash10-0mbc-1911000000-0f91de39f11722d43340
Source of Spectrum E1-38-1443-14
Synonyms 5-Methoxy-3-(4-methyl-1-cyclohex-3-enyl)-3,4-dihydro-2H-1-benzopyran-8-carboxylic acid 5-Methoxy-3-(4-methyl-3-cyclohexen-1-yl)-8-chromanecarboxylic acid 5-Methoxy-3-(4-methylcyclohex-3-en-1-yl)-3,4-dihydro-2H-chromene-8-carboxylic acid 5-Methoxy-3-(4-methylcyclohex-3-en-1-yl)chroman-8-carboxylic acid 5-Methoxy-3-(4-methylcyclohex-3-en-1-yl)chromane-8-carboxylic acid
Wiley ID 1598344