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3,7-Cyclodecadiene-1-acetic acid, 5-(methoxymethoxy)-4,8-dimethyl-2-oxo-, ethyl ester, [1S-(1R*,3Z,5S*,7E)]-
SpectraBase Compound ID 45AcxZ0asym
InChI InChI=1S/C18H28O5/c1-5-22-18(20)11-15-8-6-13(2)7-9-17(23-12-21-4)14(3)10-16(15)19/h7,10,15,17H,5-6,8-9,11-12H2,1-4H3/b13-7-,14-10-/t15-,17+/m0/s1
InChIKey WFHUJFHAQUQXAV-MKZDCMMASA-N
Mol Weight 324.42 g/mol
Molecular Formula C18H28O5
Exact Mass 324.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TSzqORbuiu
Name 3,7-Cyclodecadiene-1-acetic acid, 5-(methoxymethoxy)-4,8-dimethyl-2-oxo-, ethyl ester, [1S-(1R*,3Z,5S*,7E)]-
CAS Registry Number 81780-79-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O5
InChI InChI=1S/C18H28O5/c1-5-22-18(20)11-15-8-6-13(2)7-9-17(23-12-21-4)14(3)10-16(15)19/h7,10,15,17H,5-6,8-9,11-12H2,1-4H3/b13-7-,14-10-/t15-,17+/m0/s1
InChIKey WFHUJFHAQUQXAV-MKZDCMMASA-N
Molecular Weight 324.417 g/mol
SMILES C1(\C=C/([C@@](C\C=C/(CC[C@]1(CC(=O)OCC)[H])C)(OCOC)[H])C)=O
SPLASH splash10-0002-9030000000-42c9c8b0eeb97881d9bc
Source of Spectrum AJ-58-150-13
Synonyms Ethyl (3R,7S,1(10)e,4Z)-3-methoxymethoxy-6-oxo-13-nor-1(10),4-germecradien-12-oate Ethyl[(1S,5R)-5-(methoxymethoxy)-4,8-dimethyl-2-oxo-3,7-cyclodecadien-1-yl]acetate
Wiley ID 1323225