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CXFRCDNOIZMJRP-UHFFFAOYSA-N
SpectraBase Compound ID 3M0YIxdR6x2
InChI InChI=1S/C21H38O4/c1-14(13-22)6-5-7-15(2)18-9-8-16(3)21(18)11-10-17(19(23)12-21)20(24)25-4/h14-19,22-23H,5-13H2,1-4H3
InChIKey CXFRCDNOIZMJRP-UHFFFAOYSA-N
Mol Weight 354.5 g/mol
Molecular Formula C21H38O4
Exact Mass 354.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8sGdvPbg3
Name Spiro[4.5]decane-8-carboxylic acid, 7-hydroxy-1-(6-hydroxy-1,5-dimethylhexyl)-4-methyl-, methyl ester
CAS Registry Number 90363-87-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H38O4
InChI InChI=1S/C21H38O4/c1-14(13-22)6-5-7-15(2)18-9-8-16(3)21(18)11-10-17(19(23)12-21)20(24)25-4/h14-19,22-23H,5-13H2,1-4H3
InChIKey CXFRCDNOIZMJRP-UHFFFAOYSA-N
Molecular Weight 354.531 g/mol
SMILES OC1CC2(C(C(CCCC(CO)C)C)CCC2C)CCC1C(=O)OC
SPLASH splash10-0a4i-4922000000-950a654821a67319bf88
Source of Spectrum B-37-644-0
Synonyms Methyl 7-hydroxy-1-(6-hydroxy-1,5-dimethylhexyl)-4-methylspiro[4.5]decane-8-carboxylate Methyl ester of saturated acorane isoprenologue
Wiley ID 1344808