ADB-BICA

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Systematic / IUPAC Name: N-(1-Amino-3,3-dimethyl-1-oxo-2-butanyl)-1-benzyl-1H-indole-3-carboxamide

ID: Reference6912

Other Names: 1H-Indole-3-carboxamide, N-[1-(aminocarbonyl)-2,2-dimethylpropyl]-1-(phenylmethyl)-

Formula: C22H25N3O2

Spectral Data

ADB-BICA 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 Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 238
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/13/2017 9:33:01 AM
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Identificators

InChI InChI=1S/C22H25N3O2/c1-22(2,3)19(20(23)26)24-21(27)17-14-25(13-15-9-5-4-6-10-15)18-12-8-7-11-16(17)18/h4-12,14,19H,13H2,1-3H3,(H2,23,26)(H,24,27)
InChI Key OGVITAUBEIIKNT-UHFFFAOYSA-N
Canonical SMILES O=C(NC(C(N)=O)C(C)(C)C)C1=CN(CC2=CC=CC=C2)C3=C1C=CC=C3
CAS
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Other Names 1H-Indole-3-carboxamide, N-[1-(aminocarbonyl)-2,2-dimethylpropyl]-1-(phenylmethyl)-

In Other Databases

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