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3',3',5'-Trimethylcyclohexyl (3-thienylglycol)carboxylate
SpectraBase Compound ID 72vnB58TNsU
InChI InChI=1S/C15H22O3S/c1-10-6-12(8-15(2,3)7-10)18-14(17)13(16)11-4-5-19-9-11/h4-5,9-10,12-13,16H,6-8H2,1-3H3/t10-,12+,13?/m1/s1
InChIKey YZIKFEFDBXBIQI-FVBASEICSA-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 5dAYaRPGLu
Name 3',3',5'-Trimethylcyclohexyl (3-thienylglycol)carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3S
InChI InChI=1S/C15H22O3S/c1-10-6-12(8-15(2,3)7-10)18-14(17)13(16)11-4-5-19-9-11/h4-5,9-10,12-13,16H,6-8H2,1-3H3/t10-,12+,13?/m1/s1
InChIKey YZIKFEFDBXBIQI-FVBASEICSA-N
Molecular Weight 282.398 g/mol
SMILES OC(c1cscc1)C(O[C@@]1(CC(C)(C)C[C@@](C1)(C)[H])[H])=O
SPLASH splash10-02t9-9500000000-33ba2c1b377dcd3b5600
Source of Spectrum D8-323-213-3
Synonyms 3,3,5-trimethylcyclohexyl hydroxy(3-thienyl)acetate
Wiley ID 1513664