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3-0-chlorobenzoyloxy-6-methoxytropan
SpectraBase Compound ID ICXeE0BT12s
InChI InChI=1S/C16H20ClNO3/c1-18-10-7-11(9-14(18)15(8-10)20-2)21-16(19)12-5-3-4-6-13(12)17/h3-6,10-11,14-15H,7-9H2,1-2H3/t10-,11?,14+,15?/m0/s1
InChIKey QJPRUDTWAQOPSS-QSORXEQWSA-N
Mol Weight 309.79 g/mol
Molecular Formula C16H20ClNO3
Exact Mass 309.113171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJHT5NIiIRM
Name 3-0-chlorobenzoyloxy-6-methoxytropan
Alternate Name(s) 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 2-chlorobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20ClNO3
InChI InChI=1S/C16H20ClNO3/c1-18-10-7-11(9-14(18)15(8-10)20-2)21-16(19)12-5-3-4-6-13(12)17/h3-6,10-11,14-15H,7-9H2,1-2H3/t10-,11?,14+,15?/m0/s1
InChIKey QJPRUDTWAQOPSS-QSORXEQWSA-N
Molecular Weight 309.793 g/mol
SMILES [C@@]12(N([C@@](C(C2)OC)(CC(OC(c2c(Cl)cccc2)=O)C1)[H])C)[H]
SPLASH splash10-0f6y-9212000000-a576872986c0d88939d0
Source of Spectrum SI-39-77-0
Wiley ID 1310596