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1H-2,6,10-(Epoxymethyno)-3-benzazacyclododecine, 2,3,4,5-tetrahydro-9,12,13-trimethoxy-3-methyl-, (+)-
SpectraBase Compound ID DNhUY5oICMJ
InChI InChI=1S/C20H23NO4/c1-21-8-7-12-5-6-15(22-2)19-14-11-17(24-4)16(23-3)9-13(14)10-18(21)25-20(12)19/h5-6,9,11,18H,7-8,10H2,1-4H3
InChIKey PUHUCEOREZKVOM-UHFFFAOYSA-N
Mol Weight 341.41 g/mol
Molecular Formula C20H23NO4
Exact Mass 341.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C8nTOS3kpX7
Name 1H-2,6,10-(Epoxymethyno)-3-benzazacyclododecine, 2,3,4,5-tetrahydro-9,12,13-trimethoxy-3-methyl-, (+)-
Alternate Name(s) 4,5,16-trimethoxy-10-methyl-18-oxa-10-azatetracyclo[7.7.2.0(2,7).0(13,17)]octadeca-1(17),2,4,6,13,15-hexaene Dibenzoxazabicycloundecane
CAS Registry Number 87166-99-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO4
InChI InChI=1S/C20H23NO4/c1-21-8-7-12-5-6-15(22-2)19-14-11-17(24-4)16(23-3)9-13(14)10-18(21)25-20(12)19/h5-6,9,11,18H,7-8,10H2,1-4H3
InChIKey PUHUCEOREZKVOM-UHFFFAOYSA-N
Molecular Weight 341.407 g/mol
SMILES c12-c3c4OC(Cc2cc(c(c1)OC)OC)N(C)CCc4ccc3OC
SPLASH splash10-00lr-0093000000-1ae8ccfaced262134b37
Source of Spectrum F-39-1826-0
Wiley ID 1335979