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(1'R,2'R/S,4R,5R)-4-(1-Hydroxy-2-phenylselenylpentadecanyl)-2,2-dimethyl[1,3]dioxan-5-ol

View entire compound with spectra: 1 MS (GC)

(1'R,2'R/S,4R,5R)-4-(1-Hydroxy-2-phenylselenylpentadecanyl)-2,2-dimethyl[1,3]dioxan-5-ol
SpectraBase Compound ID 8cB5c75YDVR
InChI InChI=1S/C27H46O4Se/c1-4-5-6-7-8-9-10-11-12-13-17-20-24(32-22-18-15-14-16-19-22)25(29)26-23(28)21-30-27(2,3)31-26/h14-16,18-19,23-26,28-29H,4-13,17,20-21H2,1-3H3/t23-,24?,25+,26-/m1/s1
InChIKey CLSRPISEYOIMQP-SDFBABIMSA-N
Mol Weight 513.6 g/mol
Molecular Formula C27H46O4Se
Exact Mass 514.256132 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ANJT7lobssD
Name (1'R,2'R/S,4R,5R)-4-(1-Hydroxy-2-phenylselenylpentadecanyl)-2,2-dimethyl[1,3]dioxan-5-ol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46O4Se
InChI InChI=1S/C27H46O4Se/c1-4-5-6-7-8-9-10-11-12-13-17-20-24(32-22-18-15-14-16-19-22)25(29)26-23(28)21-30-27(2,3)31-26/h14-16,18-19,23-26,28-29H,4-13,17,20-21H2,1-3H3/t23-,24?,25+,26-/m1/s1
InChIKey CLSRPISEYOIMQP-SDFBABIMSA-N
Molecular Weight 513.633 g/mol
SMILES O[C@@]1(COC(O[C@]1([C@](C([Se]c1ccccc1)CCCCCCCCCCCCC)(O)[H])[H])(C)C)[H]
SPLASH splash10-03dj-0070090000-bd380820f39606d954fc
Source of Spectrum QE-1-385-6
Synonyms (1'R,2'R/S,4S,5R)-4-(1-Hydroxy-2-phenylselenylpentadecanyl)-2,2-dimethyl[1,3]dioxan-5-ol (4R,5R)-4-[(1R)-1-hydroxy-2-(phenylselanyl)pentadecyl]-2,2-dimethyl-1,3-dioxan-5-ol
Wiley ID 842422