2-[1-Oxo-2(1H)-phthalazinyl]ethyl N-[(4-methylphenyl)sulfonyl]carbamate

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Systematic / IUPAC Name: 2-(1-Oxo-2(1H)-phthalazinyl)ethyl [(4-methylphenyl)sulfonyl]carbamate

ID: Reference3691

Other Names: 2-(1-Oxo-1,2-dihydrophthalazin-2-yl)ethyl N-[(4-methylbenzene)sulfonyl]carbamate;
Carbamic acid, N-[(4-methylphenyl)sulfonyl], 2-(1-oxo-2(1H)-phthalazinyl)ethyl ester

Formula: C18H17N3O5S

Spectral Data

2-[1-Oxo-2(1H)-phthalazinyl]ethyl N-[(4-methylphenyl)sulfonyl]carbamate 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 2/3/2016 2:07:33 PM
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Identificators

InChI InChI=1S/C18H17N3O5S/c1-13-6-8-15(9-7-13)27(24,25)20-18(23)26-11-10-21-17(22)16-5-3-2-4-14(16)12-19-21/h2-9,12H,10-11H2,1H3,(H,20,23)
InChI Key XBQFDRFZNUYZCG-UHFFFAOYSA-N
Canonical SMILES CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OCCN2C(=O)C3=CC=CC=C3C=N2
CAS
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Other Names 2-(1-Oxo-1,2-dihydrophthalazin-2-yl)ethyl N-[(4-methylbenzene)sulfonyl]carbamate;
Carbamic acid, N-[(4-methylphenyl)sulfonyl], 2-(1-oxo-2(1H)-phthalazinyl)ethyl ester

In Other Databases

PubChem 2811160
ChemSpider 2089572