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cis-Cyclohexanespiro-4'-[3'-(methoxycarbonyl)-2'-methyl-4'-butanolide]
SpectraBase Compound ID HdgkGc6f4VS
InChI InChI=1S/C12H18O4/c1-8-9(11(14)15-2)12(16-10(8)13)6-4-3-5-7-12/h8-9H,3-7H2,1-2H3/t8-,9-/m1/s1
InChIKey BMISGXGRFJIXOI-RKDXNWHRSA-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 2RGOOaWiChw
Name cis-Cyclohexanespiro-4'-[3'-(methoxycarbonyl)-2'-methyl-4'-butanolide]
Alternate Name(s) Methyl (3R,4S)-3-methyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-8-9(11(14)15-2)12(16-10(8)13)6-4-3-5-7-12/h8-9H,3-7H2,1-2H3/t8-,9-/m1/s1
InChIKey BMISGXGRFJIXOI-RKDXNWHRSA-N
Molecular Weight 226.272 g/mol
SMILES [C@@]1(C2(OC([C@@]1(C)[H])=O)CCCCC2)(C(=O)OC)[H]
SPLASH splash10-066u-9100000000-9f967b0f21ae62a88be6
Source of Spectrum F-49-1599-9
Wiley ID 1227389