5,7,9b-Trihydroxy-6,6,9a-trimethyl-5,5a,6,7,8,9,9a,9b-octahydronaphtho[1,2-c]furan-1(3H)-one

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Systematic / IUPAC Name: 5,7,9b-Trihydroxy-6,6,9a-trimethyl-3,5,5a,7,8,9-hexahydrobenzo[g][2]benzofuran-1-one

ID: Reference8013

Other Names: Naphtho[1,2-c]furan-1(3H)-one, 5,5a,6,7,8,9,9a,9b-octahydro-5,7,9b-trihydroxy-6,6,9a-trimethyl-

Formula: C15H22O5

Spectral Data

5,7,9b-Trihydroxy-6,6,9a-trimethyl-5,5a,6,7,8,9,9a,9b-octahydronaphtho[1,2-c]furan-1(3H)-one mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 260
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 5/31/2018 10:20:46 AM
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Identificators

InChI InChI=1S/C15H22O5/c1-13(2)10(17)4-5-14(3)11(13)9(16)6-8-7-20-12(18)15(8,14)19/h6,9-11,16-17,19H,4-5,7H2,1-3H3
InChI Key BWUOMAQMSRDZPZ-UHFFFAOYSA-N
Canonical SMILES CC1(C(CCC2(C1C(C=C3C2(C(=O)OC3)O)O)C)O)C
CAS
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Other Names Naphtho[1,2-c]furan-1(3H)-one, 5,5a,6,7,8,9,9a,9b-octahydro-5,7,9b-trihydroxy-6,6,9a-trimethyl-

In Other Databases

ChemSpider 22943232
PubChem 44715269