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Cyclopenta[b]pyran-3-carboxylic acid, 2,4a,5,6,7,7a-hexahydro-2-methoxy-, methyl ester, (2.alpha.,4a.alpha.,7a.alpha.)-(.+-.)-
SpectraBase Compound ID H6rTxvG2dKx
InChI InChI=1S/C11H16O4/c1-13-10(12)8-6-7-4-3-5-9(7)15-11(8)14-2/h6-7,9,11H,3-5H2,1-2H3/t7-,9-,11+/m0/s1
InChIKey BOMIYCRTUQKITP-OVYXKVPISA-N
Mol Weight 212.24 g/mol
Molecular Formula C11H16O4
Exact Mass 212.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4gBAjaEQXup
Name Cyclopenta[b]pyran-3-carboxylic acid, 2,4a,5,6,7,7a-hexahydro-2-methoxy-, methyl ester, (2.alpha.,4a.alpha.,7a.alpha.)-(.+-.)-
CAS Registry Number 67546-35-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O4
InChI InChI=1S/C11H16O4/c1-13-10(12)8-6-7-4-3-5-9(7)15-11(8)14-2/h6-7,9,11H,3-5H2,1-2H3/t7-,9-,11+/m0/s1
InChIKey BOMIYCRTUQKITP-OVYXKVPISA-N
Molecular Weight 212.245 g/mol
SMILES C1(=C[C@@]2(CCC[C@@]2(O[C@]1(OC)[H])[H])[H])C(=O)OC
SPLASH splash10-001i-0900000000-dadf0bf6ffff094c21bc
Source of Spectrum K-111-2434-0
Synonyms Methyl (2R,4aS,7aS)-2-methoxy-2,4a,5,6,7,7a-hexahydrocyclopenta[b]pyran-3-carboxylate Methyl ester of (+,-)-2.alpha.-methoxy-2,4a.alpha.,5,6,7,7a.alpha.-hexahydrocyclopenta(c)pyran-3-carboxylic acid
Wiley ID 1211190