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3',3',5'-Trimethylcyclohexyl (2-thienylglycol)carboxylate
SpectraBase Compound ID 3JwJYRZL0qW
InChI InChI=1S/C15H22O3S/c1-10-7-11(9-15(2,3)8-10)18-14(17)13(16)12-5-4-6-19-12/h4-6,10-11,13,16H,7-9H2,1-3H3/t10-,11+,13?/m1/s1
InChIKey CNEXVEJBJXSJBF-ILWADHIDSA-N
Mol Weight 282.4 g/mol
Molecular Formula C15H22O3S
Exact Mass 282.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AfIBuhHF5zn
Name 3',3',5'-Trimethylcyclohexyl (2-thienylglycol)carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3S
InChI InChI=1S/C15H22O3S/c1-10-7-11(9-15(2,3)8-10)18-14(17)13(16)12-5-4-6-19-12/h4-6,10-11,13,16H,7-9H2,1-3H3/t10-,11+,13?/m1/s1
InChIKey CNEXVEJBJXSJBF-ILWADHIDSA-N
Molecular Weight 282.398 g/mol
SMILES OC(C(O[C@@]1(CC(C)(C)C[C@@](C1)(C)[H])[H])=O)c1sccc1
SPLASH splash10-07vl-9300000000-64aaa367bd7b555cb734
Source of Spectrum D8-323-212-2
Synonyms 3,3,5-trimethylcyclohexyl hydroxy(2-thienyl)acetate
Wiley ID 1513666