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1,4-Methano-4H-3,4-benzoxazocine, 2-(3,4-dimethoxyphenyl)-1,2,5,6-tetrahydro-8,9-dimethoxy-, (1.alpha.,2.beta.,4.alpha.)-(.+-.)-

View entire compound with spectra: 1 MS (GC)

1,4-Methano-4H-3,4-benzoxazocine, 2-(3,4-dimethoxyphenyl)-1,2,5,6-tetrahydro-8,9-dimethoxy-, (1.alpha.,2.beta.,4.alpha.)-(.+-.)-
SpectraBase Compound ID 9JXsocw8c2A
InChI InChI=1S/C21H25NO5/c1-23-17-6-5-14(10-18(17)24-2)21-16-12-22(27-21)8-7-13-9-19(25-3)20(26-4)11-15(13)16/h5-6,9-11,16,21H,7-8,12H2,1-4H3
InChIKey IVPADXOBXCMRQL-UHFFFAOYSA-N
Mol Weight 371.43 g/mol
Molecular Formula C21H25NO5
Exact Mass 371.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1O2S3Fjp0FM
Name 1,4-Methano-4H-3,4-benzoxazocine, 2-(3,4-dimethoxyphenyl)-1,2,5,6-tetrahydro-8,9-dimethoxy-, (1.alpha.,2.beta.,4.alpha.)-(.+-.)-
Alternate Name(s) (1RS,2RS,4RS)-2-(3,4-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydro-2H-1,4-methano-4H-3,4-benzoxazocine 12-(3,4-dimethoxyphenyl)-4,5-dimethoxy-11-oxa-10-azatricyclo[8.2.1.0(2,7)]trideca-2,4,6-triene
CAS Registry Number 74904-74-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO5
InChI InChI=1S/C21H25NO5/c1-23-17-6-5-14(10-18(17)24-2)21-16-12-22(27-21)8-7-13-9-19(25-3)20(26-4)11-15(13)16/h5-6,9-11,16,21H,7-8,12H2,1-4H3
InChIKey IVPADXOBXCMRQL-UHFFFAOYSA-N
Molecular Weight 371.433 g/mol
SMILES C12c3c(cc(c(c3)OC)OC)CCN(C1)OC2c1cc(OC)c(cc1)OC
SPLASH splash10-0ufr-0937000000-e0cb4af92d699364726c
Source of Spectrum B-33-393-0
Wiley ID 1355005