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Methyl-(+)-4-[(1'S,2'R)-2'-methyl-3',3'-dimethoxycyclohexyl]butyrate
SpectraBase Compound ID 99O4N5d2RDg
InChI InChI=1S/C14H26O4/c1-11-12(7-5-9-13(15)16-2)8-6-10-14(11,17-3)18-4/h11-12H,5-10H2,1-4H3/t11-,12-/m1/s1
InChIKey TVHRTDUMNGRACG-VXGBXAGGSA-N
Mol Weight 258.36 g/mol
Molecular Formula C14H26O4
Exact Mass 258.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWVCeSDNQtt
Name Methyl-(+)-4-[(1'S,2'R)-2'-methyl-3',3'-dimethoxycyclohexyl]butyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H26O4
InChI InChI=1S/C14H26O4/c1-11-12(7-5-9-13(15)16-2)8-6-10-14(11,17-3)18-4/h11-12H,5-10H2,1-4H3/t11-,12-/m1/s1
InChIKey TVHRTDUMNGRACG-VXGBXAGGSA-N
Molecular Weight 258.358 g/mol
SMILES C1([C@@]([C@](CCCC(=O)OC)(CCC1)[H])(C)[H])(OC)OC
SPLASH splash10-004i-5900000000-cb382658f24eba1b5888
Source of Spectrum H-67-841-0
Synonyms Methyl 4-[(1S,2R)-3,3-dimethoxy-2-methylcyclohexyl]butanoate
Wiley ID 1261725