(3R,4R)-N-Benzyl-4-hydroxy-3-[(4-methoxybenzoyl)amino]-1-azepanecarboxamide

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Systematic / IUPAC Name: (3R,4R)-N-Benzyl-4-hydroxy-3-[(4-methoxybenzoyl)amino]azepane-1-carboxamide

ID: Reference12897

Other Names: NAT10-367991

Formula: C22H27N3O4

Spectral Data

(3R,4R)-N-Benzyl-4-hydroxy-3-[(4-methoxybenzoyl)amino]-1-azepanecarboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1470
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/23/2023 9:23:09 AM
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Identificators

InChI InChI=1S/C22H27N3O4/c1-29-18-11-9-17(10-12-18)21(27)24-19-15-25(13-5-8-20(19)26)22(28)23-14-16-6-3-2-4-7-16/h2-4,6-7,9-12,19-20,26H,5,8,13-15H2,1H3,(H,23,28)(H,24,27)/t19-,20-/m1/s1
InChI Key CPKYZFBJYGDTFG-WOJBJXKFSA-N
Canonical SMILES COC1=CC=C(C=C1)C(=O)NC2CN(CCCC2O)C(=O)NCC3=CC=CC=C3
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Other Names NAT10-367991

In Other Databases

PubChem 26742072
ChemSpider 21379899