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Ethyl 10-formyl-3-hydroxy-6,6-dimethyl-8,9,10,10a-tetrahydro-6H-benzo[c]chromene-9-carboxylate
SpectraBase Compound ID dzrdAUZPIv
InChI InChI=1S/C19H22O5/c1-4-23-18(22)12-7-8-15-17(14(12)10-20)13-6-5-11(21)9-16(13)24-19(15,2)3/h5-6,8-10,12,14,17,21H,4,7H2,1-3H3/t12-,14+,17+/m0/s1
InChIKey NVJONPIPCATRDG-DXCKQFNASA-N
Mol Weight 330.38 g/mol
Molecular Formula C19H22O5
Exact Mass 330.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9psl9NWKaNh
Name Ethyl 10-formyl-3-hydroxy-6,6-dimethyl-8,9,10,10a-tetrahydro-6H-benzo[c]chromene-9-carboxylate
Alternate Name(s) (9S,10S,10aS)-ethyl 10-formyl-3-hydroxy-6,6-dimethyl-8,9,10,10a-tetrahydro-6H-benzo[c]chromene-9-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O5
InChI InChI=1S/C19H22O5/c1-4-23-18(22)12-7-8-15-17(14(12)10-20)13-6-5-11(21)9-16(13)24-19(15,2)3/h5-6,8-10,12,14,17,21H,4,7H2,1-3H3/t12-,14+,17+/m0/s1
InChIKey NVJONPIPCATRDG-DXCKQFNASA-N
Literature Reference DOI 10.1021/co200107s
Molecular Weight 330.380 g/mol
SMILES Oc1ccc2c(c1)OC(C)(C)C1=CC[C@@]([C@]([C@@]21[H])(C=O)[H])(C(OCC)=O)[H]
SPLASH splash10-0006-9000000000-79acaeb14d1815d9d741
Source of Spectrum ACS-13-554/SM29-21{2,6}_Exo
Wiley ID 1754086