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(2E)-2-[(2S,3S,6R)-2-hydroxy-3-isopropyl-6-methyl-cyclohexylidene]acetic acid ethyl ester
SpectraBase Compound ID Fh9g8IuKYeE
InChI InChI=1S/C14H24O3/c1-5-17-13(15)8-12-10(4)6-7-11(9(2)3)14(12)16/h8-11,14,16H,5-7H2,1-4H3/b12-8+/t10-,11+,14+/m1/s1
InChIKey ARTKVLSARUZRGA-XGWRTZLMSA-N
Mol Weight 240.34 g/mol
Molecular Formula C14H24O3
Exact Mass 240.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EVExG3MDTTp
Name (2E)-2-[(2S,3S,6R)-2-hydroxy-3-isopropyl-6-methyl-cyclohexylidene]acetic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O3
InChI InChI=1S/C14H24O3/c1-5-17-13(15)8-12-10(4)6-7-11(9(2)3)14(12)16/h8-11,14,16H,5-7H2,1-4H3/b12-8+/t10-,11+,14+/m1/s1
InChIKey ARTKVLSARUZRGA-XGWRTZLMSA-N
Molecular Weight 240.343 g/mol
SMILES O[C@@]1(\C(=C\C(=O)OCC)[C@@](CC[C@]1(C(C)C)[H])(C)[H])[H]
SPLASH splash10-004i-0910000000-5a196408ed127d60962e
Source of Spectrum E2-52-312-1
Synonyms (2E)-2-[(2S,3S,6R)-2-hydroxy-6-methyl-3-propan-2-ylcyclohexylidene]acetic acid ethyl ester Ethyl (2E)-2-[(2S,3S,6R)-2-hydroxy-3-isopropyl-6-methyl-cyclohexylidene]acetate Ethyl (2E)-2-[(2S,3S,6R)-2-hydroxy-6-methyl-3-propan-2-ylcyclohexylidene]acetate Ethyl (2E)-2-[(2S,3S,6R)-6-methyl-2-oxidanyl-3-propan-2-yl-cyclohexylidene]ethanoate
Wiley ID 1556357