SSR180711

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Systematic / IUPAC Name: 4-Bromophenyl 1,4-diazabicyclo[3.2.2]nonane-4-carboxylate

ID: Reference2875

Other Names: 1,4-Diazabicyclo[3.2.2]nonane-4-carboxylic acid, 4-bromophenyl ester;
SSR-180711

Formula: C14H17BrN2O2

Spectral Data

SSR180711 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 Orbitrap
No. of Spectral Trees 1
No. of Spectra 118
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 6/26/2015 9:20:29 AM
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Identificators

InChI InChI=1S/C14H17BrN2O2/c15-11-1-3-13(4-2-11)19-14(18)17-10-9-16-7-5-12(17)6-8-16/h1-4,12H,5-10H2
InChI Key RXLOZRCLQMJJLC-UHFFFAOYSA-N
Canonical SMILES C1CN2CCC1N(CC2)C(=O)OC3=CC=C(C=C3)Br
CAS 298198524
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Other Names 1,4-Diazabicyclo[3.2.2]nonane-4-carboxylic acid, 4-bromophenyl ester;
SSR-180711

In Other Databases

ChEMBL CHEMBL559478
Wikipedia SSR-180,711
PubChem 9797360
ChemSpider 7973126