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(2S)-2-[3,4-Dihydro-2,2-dimethyl-8-(3-methylbut-2-enyl)-2H-1-benzopyran-6-yl]-2,3,9,10-tetrahydro-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(2S)-2-[3,4-Dihydro-2,2-dimethyl-8-(3-methylbut-2-enyl)-2H-1-benzopyran-6-yl]-2,3,9,10-tetrahydro-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
SpectraBase Compound ID IEGEReW9KZ1
InChI InChI=1S/C30H36O4/c1-18(2)7-8-19-15-21(16-20-11-13-30(5,6)34-27(19)20)26-17-24(31)22-9-10-25-23(28(22)32-26)12-14-29(3,4)33-25/h7,9-10,15-16,26H,8,11-14,17H2,1-6H3/t26-/m0/s1
InChIKey ZEQDKNXZIPLWAT-SANMLTNESA-N
Mol Weight 460.6 g/mol
Molecular Formula C30H36O4
Exact Mass 460.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6XfXDDsBQAr
Name (2S)-2-[3,4-Dihydro-2,2-dimethyl-8-(3-methylbut-2-enyl)-2H-1-benzopyran-6-yl]-2,3,9,10-tetrahydro-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H36O4
InChI InChI=1S/C30H36O4/c1-18(2)7-8-19-15-21(16-20-11-13-30(5,6)34-27(19)20)26-17-24(31)22-9-10-25-23(28(22)32-26)12-14-29(3,4)33-25/h7,9-10,15-16,26H,8,11-14,17H2,1-6H3/t26-/m0/s1
InChIKey ZEQDKNXZIPLWAT-SANMLTNESA-N
Literature Reference DOI 10.1002/hlca.200690000
Molecular Weight 460.614 g/mol
SMILES CC1(CCc2c(O1)ccc1C(C[C@@](c3cc4c(c(c3)CC=C(C)C)OC(C)(C)CC4)(Oc21)[H])=O)C
SPLASH splash10-0007-3960000000-07167b473e6f79092335
Source of Spectrum H-89-109-1
Synonyms Tonkinochromane A (S)-2-(2,2-dimethyl-8-(3-methylbut-2-en-1-yl)chroman-6-yl)-8,8-dimethyl-2,3,9,10-tetrahydro-4H,8H-pyrano[2,3-f]chromen-4-one
Wiley ID 1785628