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(1R,2R)-trans-Cyclohexandiol mono-p-dimethylaminophenylacetate
SpectraBase Compound ID B6UgzKrJCP9
InChI InChI=1S/C16H23NO3/c1-17(2)13-9-7-12(8-10-13)11-16(19)20-15-6-4-3-5-14(15)18/h7-10,14-15,18H,3-6,11H2,1-2H3/t14-,15-/m1/s1
InChIKey JCSVDYSVQZUVKT-HUUCEWRRSA-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 7lXFBmZdiiE
Name (1R,2R)-trans-Cyclohexandiol mono-p-dimethylaminophenylacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO3
InChI InChI=1S/C16H23NO3/c1-17(2)13-9-7-12(8-10-13)11-16(19)20-15-6-4-3-5-14(15)18/h7-10,14-15,18H,3-6,11H2,1-2H3/t14-,15-/m1/s1
InChIKey JCSVDYSVQZUVKT-HUUCEWRRSA-N
Molecular Weight 277.364 g/mol
SMILES O[C@]1([C@](OC(=O)Cc2ccc(N(C)C)cc2)(CCCC1)[H])[H]
SPLASH splash10-001i-0900000000-feecca53e594464d61ea
Source of Spectrum F-47-9769-10
Wiley ID 1281105