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2-Pentenoic acid, 3-methyl-5-(octahydro-5',5',8'a-trimethylspiro[1,3-dioxolane-2,2'(1'H)-naphthalen]-1'-yl)-, methyl ester, [1'S-[1'.alpha.(E),4'a.beta.,8'a.alpha.]]-
SpectraBase Compound ID 5JaikidwM0b
InChI InChI=1S/C22H36O4/c1-16(15-19(23)24-5)7-8-18-21(4)11-6-10-20(2,3)17(21)9-12-22(18)25-13-14-26-22/h15,17-18H,6-14H2,1-5H3/b16-15+/t17-,18+,21-/m1/s1
InChIKey HFEXWXIPQUHLIP-MQQSOOADSA-N
Mol Weight 364.5 g/mol
Molecular Formula C22H36O4
Exact Mass 364.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gl8DrhhdMmK
Name 2-Pentenoic acid, 3-methyl-5-(octahydro-5',5',8'a-trimethylspiro[1,3-dioxolane-2,2'(1'H)-naphthalen]-1'-yl)-, methyl ester, [1'S-[1'.alpha.(E),4'a.beta.,8'a.alpha.]]-
CAS Registry Number 126569-90-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36O4
InChI InChI=1S/C22H36O4/c1-16(15-19(23)24-5)7-8-18-21(4)11-6-10-20(2,3)17(21)9-12-22(18)25-13-14-26-22/h15,17-18H,6-14H2,1-5H3/b16-15+/t17-,18+,21-/m1/s1
InChIKey HFEXWXIPQUHLIP-MQQSOOADSA-N
Molecular Weight 364.526 g/mol
SMILES [C@@]12([C@@](C3(OCCO3)CC[C@@]1(C(C)(C)CCC2)[H])(CC\C(=C\C(=O)OC)C)[H])C
SPLASH splash10-0002-9100000000-f69e1784859221e0f993
Source of Spectrum B-42-575-34
Synonyms Spiro[1,3-dioxolane-2,2'(1'H)-naphthalene], 2-pentenoic acid deriv. 1-(4'-Methoxycarbonyl-3'-methyl-but-3'-enyl)-2,2-methylenedioxy-7-hydroxy-5,5,8a-trimethyl-perhydronaphthalene 1-(4'-Methoxycarbonyl-3'-methylbut-3'-enyl)-2,2-methylenedioxy-5,5,8a-trimethyl-perhydronaphthalene Methyl (2E)-5-[(1'S,4'aR,8'aR)-5',5',8'a-trimethyl-octahydro-1'H-spiro[1,3-dioxolane-2,2'-naphthalene]-1'-yl]-3-methylpent-2-enoate
Wiley ID 1351023