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Spiro[1,3-dioxolane-2,1'(2'H)-pentalene]-6'-carboxylic acid, hexahydro-, methyl ester, (3'a.alpha.,6'.beta.,6'a.alpha.)-
SpectraBase Compound ID SEbSg3bo7X
InChI InChI=1S/C12H18O4/c1-14-11(13)9-3-2-8-4-5-12(10(8)9)15-6-7-16-12/h8-10H,2-7H2,1H3/t8-,9-,10+/m1/s1
InChIKey ODYDCUNNMQGDQC-BBBLOLIVSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EAgonYEOjZ0
Name Spiro[1,3-dioxolane-2,1'(2'H)-pentalene]-6'-carboxylic acid, hexahydro-, methyl ester, (3'a.alpha.,6'.beta.,6'a.alpha.)-
Alternate Name(s) 8,8-Athylendioxybicyclo[3.3.0]octan-2-endo-carbonsaure-methylester 8,8-ethylendioxybicyclo[3.3.0]octan-2-endo-carbonic acid, methyl ester Methyl (3'aR,6'R,6'aS)-hexahydro-2'H-spiro[1,3-dioxolane-2,1'-pentalene]-6'-carboxylate
CAS Registry Number 69641-95-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-14-11(13)9-3-2-8-4-5-12(10(8)9)15-6-7-16-12/h8-10H,2-7H2,1H3/t8-,9-,10+/m1/s1
InChIKey ODYDCUNNMQGDQC-BBBLOLIVSA-N
Molecular Weight 226.272 g/mol
SMILES C12([C@@]3([C@](C(=O)OC)(CC[C@]3([H])CC1)[H])[H])OCCO2
SPLASH splash10-0002-9100000000-6b6ee2139a5a13ccb946
Source of Spectrum H-68-503-29
Wiley ID 1227296