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Mollugin
SpectraBase Compound ID 5jOy6Kf8TxV
InChI InChI=1S/C17H16O4/c1-17(2)9-8-12-13(16(19)20-3)14(18)10-6-4-5-7-11(10)15(12)21-17/h4-9,18H,1-3H3
InChIKey VLGATXOTCNBWIT-UHFFFAOYSA-N
Mol Weight 284.31 g/mol
Molecular Formula C17H16O4
Exact Mass 284.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2O2NVnFJ8NL
Name Methyl 6-hydroxy-2,2-dimethyl-2H-benzo[h]chromene-5-carboxylate
CAS Registry Number 55481-88-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O4
InChI InChI=1S/C17H16O4/c1-17(2)9-8-12-13(16(19)20-3)14(18)10-6-4-5-7-11(10)15(12)21-17/h4-9,18H,1-3H3
InChIKey VLGATXOTCNBWIT-UHFFFAOYSA-N
Molecular Weight 284.311 g/mol
SMILES Oc1c2ccccc2c2c(C=CC(C)(C)O2)c1C(=O)OC
SPLASH splash10-0f79-1290000000-f8518a66daf7e0652cb2
Source of Spectrum W5-1989-55715-9821
Synonyms 2H-naphtho(1,2-b)pyran-5-carboxylic acid, 6-hydroxy-2,2-dimethyl-, methyl ester 2H-Naphtho[1,2-b]pyran-5-carboxylate, 2,2-dimethyl-6-hydroxy-, methyl ester 6-Hydroxy-2,2-dimethyl-5-benzo[h][1]benzopyrancarboxylic acid methyl ester 6-Hydroxy-2,2-dimethyl-benzo[h]chromene-5-carboxylic acid methyl ester Methyl 2,2-dimethyl-6-oxidanyl-benzo[h]chromene-5-carboxylate Methyl 6-hydroxy-2,2-dimethyl-benzo[h]chromene-5-carboxylate Mollugin Rubimaillin CCRIS 6432
Wiley ID 1288054