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8bjLnVxTyCr
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8bjLnVxTyCr
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Mass Spectrum (GC)
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[(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[(2Z)-6-hydroxy-2,6-dimethyl-octa-2,7-dienoxy]tetrahydropyran-2-yl]methyl acetate
SpectraBase Compound ID DSV1ieXjNX2
InChI InChI=1S/C24H36O11/c1-8-24(7,29)11-9-10-14(2)12-31-23-22(34-18(6)28)21(33-17(5)27)20(32-16(4)26)19(35-23)13-30-15(3)25/h8,10,19-23,29H,1,9,11-13H2,2-7H3/b14-10-/t19-,20-,21+,22-,23-,24?/m1/s1
InChIKey DYBLOTHNULGHDA-OLESWMTRSA-N
Mol Weight 500.5 g/mol
Molecular Formula C24H36O11
Exact Mass 500.225762 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8bjLnVxTyCr
Name [(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[(2Z)-6-hydroxy-2,6-dimethyl-octa-2,7-dienoxy]tetrahydropyran-2-yl]methyl acetate
CAS Registry Number 64813-09-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O11
InChI InChI=1S/C24H36O11/c1-8-24(7,29)11-9-10-14(2)12-31-23-22(34-18(6)28)21(33-17(5)27)20(32-16(4)26)19(35-23)13-30-15(3)25/h8,10,19-23,29H,1,9,11-13H2,2-7H3/b14-10-/t19-,20-,21+,22-,23-,24?/m1/s1
InChIKey DYBLOTHNULGHDA-OLESWMTRSA-N
Molecular Weight 500.541 g/mol
SMILES OC(C=C)(CC\C=C/(CO[C@]1([C@@]([C@]([C@@]([C@](O1)(COC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H])[H])C)C
SPLASH splash10-0udi-0901000000-06895ae213830acc710a
Source of Spectrum K-110-3116-0
Synonyms [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(2Z)-2,6-dimethyl-6-oxidanyl-octa-2,7-dienoxy]oxan-2-yl]methyl ethanoate [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(2Z)-6-hydroxy-2,6-dimethylocta-2,7-dienoxy]oxan-2-yl]methyl acetate acetic acid [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(2Z)-6-hydroxy-2,6-dimethylocta-2,7-dienoxy]-2-oxanyl]methyl ester
Wiley ID 1398820
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