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2H-2-Benzazepine-2-carboxylic acid, 1,3,4,5-tetrahydro-7,8,9-trimethoxy-1-methylene-, phenylmethyl ester
SpectraBase Compound ID FYndYVUZ5RT
InChI InChI=1S/C22H25NO5/c1-15-19-17(13-18(25-2)20(26-3)21(19)27-4)11-8-12-23(15)22(24)28-14-16-9-6-5-7-10-16/h5-7,9-10,13H,1,8,11-12,14H2,2-4H3
InChIKey GTJVVTYOOMESSC-UHFFFAOYSA-N
Mol Weight 383.44 g/mol
Molecular Formula C22H25NO5
Exact Mass 383.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kYOeUL46IL
Name 2H-2-Benzazepine-2-carboxylic acid, 1,3,4,5-tetrahydro-7,8,9-trimethoxy-1-methylene-, phenylmethyl ester
Alternate Name(s) benzyl 7,8,9-trimethoxy-1-methylene-1,3,4,5-tetrahydro-2H-2-benzazepine-2-carboxylate Benzyl 7,8,9-trimethoxy-1-methylene-2,3,4,5-tetrahydro-2-benzazepine-2-carboxylate
CAS Registry Number 126480-85-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25NO5
InChI InChI=1S/C22H25NO5/c1-15-19-17(13-18(25-2)20(26-3)21(19)27-4)11-8-12-23(15)22(24)28-14-16-9-6-5-7-10-16/h5-7,9-10,13H,1,8,11-12,14H2,2-4H3
InChIKey GTJVVTYOOMESSC-UHFFFAOYSA-N
Molecular Weight 383.444 g/mol
SMILES C1(c2c(c(OC)c(cc2CCCN1C(OCc1ccccc1)=O)OC)OC)=C
SPLASH splash10-0006-5090000000-c41a29f0f1a00bd51e3b
Source of Spectrum KC-1989-1935-17
Wiley ID 1361125