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3',3',5'-Trimethylcyclohexyl (cis)-(3-pyridylglycol)carboxylate
SpectraBase Compound ID FNDcbl84UKe
InChI InChI=1S/C16H23NO3/c1-11-7-13(9-16(2,3)8-11)20-15(19)14(18)12-5-4-6-17-10-12/h4-6,10-11,13-14,18H,7-9H2,1-3H3/t11-,13+,14?/m1/s1
InChIKey DVIFBGJGZQTSTA-LXKBMQFRSA-N
Mol Weight 277.36 g/mol
Molecular Formula C16H23NO3
Exact Mass 277.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Depd5aiULWw
Name 3',3',5'-Trimethylcyclohexyl (cis)-(3-pyridylglycol)carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO3
InChI InChI=1S/C16H23NO3/c1-11-7-13(9-16(2,3)8-11)20-15(19)14(18)12-5-4-6-17-10-12/h4-6,10-11,13-14,18H,7-9H2,1-3H3/t11-,13+,14?/m1/s1
InChIKey DVIFBGJGZQTSTA-LXKBMQFRSA-N
Molecular Weight 277.364 g/mol
SMILES OC(C(O[C@@]1(CC(C)(C)C[C@@](C1)(C)[H])[H])=O)c1cnccc1
SPLASH splash10-0aor-9500000000-bb788f0add480922e21b
Source of Spectrum D8-323-213-4
Synonyms 3,3,5-trimethylcyclohexyl hydroxy(3-pyridinyl)acetate
Wiley ID 1513662