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8-Methyl-8-azabicyclo[3.2.1]oct-3-yl 3,5-dichlorobenzoate
SpectraBase Compound ID AdiNVOrcpoe
InChI InChI=1S/C15H17Cl2NO2/c1-18-12-2-3-13(18)8-14(7-12)20-15(19)9-4-10(16)6-11(17)5-9/h4-6,12-14H,2-3,7-8H2,1H3/t12-,13+,14?
InChIKey MNJNPLVXBISNSX-PBWFPOADSA-N
Mol Weight 314.21 g/mol
Molecular Formula C15H17Cl2NO2
Exact Mass 313.063634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29D9xeYriU7
Name 8-Methyl-8-azabicyclo[3.2.1]oct-3-yl 3,5-dichlorobenzoate
CAS Registry Number 329912-91-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17Cl2NO2
InChI InChI=1S/C15H17Cl2NO2/c1-18-12-2-3-13(18)8-14(7-12)20-15(19)9-4-10(16)6-11(17)5-9/h4-6,12-14H,2-3,7-8H2,1H3/t12-,13+,14?
InChIKey MNJNPLVXBISNSX-PBWFPOADSA-N
Molecular Weight 314.212 g/mol
SMILES CN1[C@]2(CC(OC(c3cc(Cl)cc(c3)Cl)=O)C[C@@]1(CC2)[H])[H]
SPLASH splash10-00ec-9500000000-26a2e06b88e9114a6c45
Source of Spectrum AD-0-2532-0
Synonyms (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3,5-bis(chloranyl)benzoate (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3,5-dichlorobenzoate 3,5-Dichlorobenzoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester Benzoic acid, 3,5-dichloro-, 8-aza-8-methylbicyclo[3.2.1]oct-3-yl ester
Wiley ID 1420965