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(11R,12S)-9,10-Ethano-11,12-bis(hydroxymethyl)-1,4-dipropoxy-9,10-dihydroanthracene

View entire compound with spectra: 2 MS (GC)

(11R,12S)-9,10-Ethano-11,12-bis(hydroxymethyl)-1,4-dipropoxy-9,10-dihydroanthracene
SpectraBase Compound ID BvSm8yfLOAO
InChI InChI=1S/C24H30O4/c1-3-11-27-19-9-10-20(28-12-4-2)24-22-16-8-6-5-7-15(16)21(23(19)24)17(13-25)18(22)14-26/h5-10,17-18,21-22,25-26H,3-4,11-14H2,1-2H3/t17-,18+,21-,22?/m0/s1
InChIKey AIVKKNVREJLWNQ-LAVFIBBASA-N
Mol Weight 382.5 g/mol
Molecular Formula C24H30O4
Exact Mass 382.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PTvxrKjJLC
Name (11R,12S)-9,10-Ethano-11,12-bis(hydroxymethyl)-1,4-dipropoxy-9,10-dihydroanthracene
Alternate Name(s) (11S,12R)-9,10-Ethano-11,12-bis(hydroxymethyl)-1,4-dipropoxy-9,10-dihydroanthracene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30O4
InChI InChI=1S/C24H30O4/c1-3-11-27-19-9-10-20(28-12-4-2)24-22-16-8-6-5-7-15(16)21(23(19)24)17(13-25)18(22)14-26/h5-10,17-18,21-22,25-26H,3-4,11-14H2,1-2H3/t17-,18+,21-,22?/m0/s1
InChIKey AIVKKNVREJLWNQ-LAVFIBBASA-N
Molecular Weight 382.500 g/mol
SMILES OC[C@@]1([C@@]2(c3c(C([C@@]1(CO)[H])c1c2c(ccc1OCCC)OCCC)cccc3)[H])[H]
SPLASH splash10-0006-0094000000-ccb9aeb8a2a2f6565bcf
Source of Spectrum AJ-77-1392-10
Wiley ID 1577437