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1-Acetyl-4,4-bis[4-(3-bromopropoxy)-3,5-dimethoxyphenyl]piperidine
SpectraBase Compound ID F4qZVw4Padu
InChI InChI=1S/C29H39Br2NO7/c1-20(33)32-12-8-29(9-13-32,21-16-23(34-2)27(24(17-21)35-3)38-14-6-10-30)22-18-25(36-4)28(26(19-22)37-5)39-15-7-11-31/h16-19H,6-15H2,1-5H3
InChIKey ORKPZXRIMWOLKG-UHFFFAOYSA-N
Mol Weight 673.4 g/mol
Molecular Formula C29H39Br2NO7
Exact Mass 671.109329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4lrIJvmCxWr
Name 1-Acetyl-4,4-bis[4-(3-bromopropoxy)-3,5-dimethoxyphenyl]piperidine
Alternate Name(s) 1-[4,4-bis[4-(3-bromopropoxy)-3,5-dimethoxyphenyl]-1-piperidinyl]ethanone 1-[4,4-bis[4-(3-bromopropoxy)-3,5-dimethoxyphenyl]piperidin-1-yl]ethanone 1-[4,4-bis[4-(3-bromopropoxy)-3,5-dimethoxy-phenyl]-1-piperidyl]ethanone 1-[4,4-bis[4-(3-bromanylpropoxy)-3,5-dimethoxy-phenyl]piperidin-1-yl]ethanone
Comments Less than 3 mono-isotopic peaks
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Formula C29H39Br2NO7
InChI InChI=1S/C29H39Br2NO7/c1-20(33)32-12-8-29(9-13-32,21-16-23(34-2)27(24(17-21)35-3)38-14-6-10-30)22-18-25(36-4)28(26(19-22)37-5)39-15-7-11-31/h16-19H,6-15H2,1-5H3
InChIKey ORKPZXRIMWOLKG-UHFFFAOYSA-N
Molecular Weight 673.439 g/mol
SMILES C1(c2cc(OC)c(c(c2)OC)OCCCBr)(c2cc(OC)c(c(c2)OC)OCCCBr)CCN(CC1)C(=O)C
SPLASH splash10-00di-0000009000-7c7b33fa53fea00ca4f4
Source of Spectrum F-47-2414-3
Wiley ID 1413941