5-[2-(3,5-Dichloro-4-pyridinyl)hydrazino]-3,3-dimethyl-5-oxopentanoic acid

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Systematic / IUPAC Name: 5-[2-(3,5-Dichloro-4-pyridinyl)hydrazino]-3,3-dimethyl-5-oxopentanoic acid

ID: Reference4441

Other Names: Pentanedioic acid, 3,3-dimethyl-, mono[2-(3,5-dichloro-4-pyridinyl)hydrazide]

Formula: C12H15Cl2N3O3

Spectral Data

5-[2-(3,5-Dichloro-4-pyridinyl)hydrazino]-3,3-dimethyl-5-oxopentanoic acid 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 2
No. of Spectra 238
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 4/7/2016 8:18:48 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C12H15Cl2N3O3/c1-12(2,4-10(19)20)3-9(18)16-17-11-7(13)5-15-6-8(11)14/h5-6H,3-4H2,1-2H3,(H,15,17)(H,16,18)(H,19,20)
InChI Key FYXCUKZJBCLISK-UHFFFAOYSA-N
Canonical SMILES CC(C)(CC(=O)NNC1=C(C=NC=C1Cl)Cl)CC(=O)O
CAS
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Other Names Pentanedioic acid, 3,3-dimethyl-, mono[2-(3,5-dichloro-4-pyridinyl)hydrazide]

In Other Databases

PubChem 2811355
ChemSpider 2089767