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1-ETHOXYCARBONYL-2,3,4,5-TETRAHYDRO-1H-1-BENZAZEPINE;MAJOR-ISOMER276

View entire compound with spectra: 2 NMR, and 1 MS (GC)

1-ETHOXYCARBONYL-2,3,4,5-TETRAHYDRO-1H-1-BENZAZEPINE;MAJOR-ISOMER276
SpectraBase Compound ID 3yHhG1cvFqK
InChI InChI=1S/C13H17NO2/c1-2-16-13(15)14-10-6-5-8-11-7-3-4-9-12(11)14/h3-4,7,9H,2,5-6,8,10H2,1H3
InChIKey HBDDUHHNGDKIDZ-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GCOPXOhZUI
Name 2,3,4,5-tetrahydro-1-benzazepine-1-carboxylic acid ethyl ester
Alternate Name(s) ethyl 2,3,4,5-tetrahydro-1-benzazepine-1-carboxylate
CAS Registry Number 64056-55-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-2-16-13(15)14-10-6-5-8-11-7-3-4-9-12(11)14/h3-4,7,9H,2,5-6,8,10H2,1H3
InChIKey HBDDUHHNGDKIDZ-UHFFFAOYSA-N
Molecular Weight 219.284 g/mol
SMILES C(N1c2c(cccc2)CCCC1)(=O)OCC
SPLASH splash10-00kb-0970000000-868d7696879cab01b6b9
Source of Spectrum J-43-319-0
Wiley ID 1218903