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14-Oxabicyclo[11.2.1]hexadeca-4,8-diene-8-carboxaldehyde, 12-(hydroxymethyl)-4,15,15-trimethyl-, [1R-(1R*,4Z,8E,12S*,13S*)]-
SpectraBase Compound ID LEgfislvzCm
InChI InChI=1S/C20H32O3/c1-15-6-4-7-16(13-21)8-5-9-17(14-22)19-12-18(11-10-15)20(2,3)23-19/h6,8,13,17-19,22H,4-5,7,9-12,14H2,1-3H3/b15-6-,16-8+/t17-,18+,19-/m0/s1
InChIKey OCMSXDINEKCCAU-UCEKVJOSSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cs0LMrHSNro
Name 14-Oxabicyclo[11.2.1]hexadeca-4,8-diene-8-carboxaldehyde, 12-(hydroxymethyl)-4,15,15-trimethyl-, [1R-(1R*,4Z,8E,12S*,13S*)]-
CAS Registry Number 105608-43-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-15-6-4-7-16(13-21)8-5-9-17(14-22)19-12-18(11-10-15)20(2,3)23-19/h6,8,13,17-19,22H,4-5,7,9-12,14H2,1-3H3/b15-6-,16-8+/t17-,18+,19-/m0/s1
InChIKey OCMSXDINEKCCAU-UCEKVJOSSA-N
Molecular Weight 320.473 g/mol
SMILES OC[C@]1([C@]2(OC([C@@](CC\C(=C/CC\C(=C/CC1)C=O)C)([H])C2)(C)C)[H])[H]
SPLASH splash10-05gi-9516000000-c37bf7cea8cf1bf9a5ab
Source of Spectrum B-39-1709-18
Synonyms (1R,12S,13S)-12-(hydroxymethyl)-4,15,15-trimethyl-14-oxabicyclo[11.2.1]hexadeca-4,8-diene-8-carbaldehyde 4,15,15-Trimethyl-8-formyl-12-hydroxymethyl-16-oxatricyclo[12.1.2]hexadeca-4,8-diene
Wiley ID 1320420