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(1R * ,1'R * ,5S * )-2-(methoxymethoxy)-2'-oxospiro[bicyclo[3.1.0]hex-2-ene-6,1'-cyclododecane]-3-carboxylate
SpectraBase Compound ID 2qOMbFlH8Xd
InChI InChI=1S/C21H32O5/c1-24-14-26-19-15(20(23)25-2)13-16-18(19)21(16)12-10-8-6-4-3-5-7-9-11-17(21)22/h16,18H,3-14H2,1-2H3/t16-,18-,21-/m0/s1
InChIKey PUISOBKXQUHTKI-MDKPJZGXSA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H32O5
Exact Mass 364.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GNVfN1c0iDT
Name (1R * ,1'R * ,5S * )-2-(methoxymethoxy)-2'-oxospiro[bicyclo[3.1.0]hex-2-ene-6,1'-cyclododecane]-3-carboxylate
Alternate Name(s) (1R,1'R,5S)-methyl 2-(methoxymethoxy)-2'-oxospiro[bicyclo[3.1.0]hex[2]ene-6,1'-cyclododecane]-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-24-14-26-19-15(20(23)25-2)13-16-18(19)21(16)12-10-8-6-4-3-5-7-9-11-17(21)22/h16,18H,3-14H2,1-2H3/t16-,18-,21-/m0/s1
InChIKey PUISOBKXQUHTKI-MDKPJZGXSA-N
Literature Reference DOI 10.1021/ol302942m
Molecular Weight 364.482 g/mol
SMILES [C@@]12([C@]3(CC(C(OC)=O)=C([C@@]13[H])OCOC)[H])C(=O)CCCCCCCCCC2
SPLASH splash10-0002-9020000000-7c2047c828782765d881
Source of Spectrum A1-14-6048/SMS10-S8
Wiley ID 1750852