12-Nitro-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine

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Systematic / IUPAC Name: 12-Nitro-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine

ID: Reference4610

Other Names: 12-Nitro-1,2,3,4,5,6,7,8,9,10-decahydrobenzo[a][12]annulene;
4'-Nitrobenzo-12-crown-4;
1,4,7,10-Benzotetraoxacyclododecin, 2,3,5,6,8,9-hexahydro-12-nitro-

Formula: C12H15NO6

Spectral Data

12-Nitro-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine 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 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 4/22/2016 11:23:51 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C12H15NO6/c14-13(15)10-1-2-11-12(9-10)19-8-6-17-4-3-16-5-7-18-11/h1-2,9H,3-8H2
InChI Key UUQRTEFANVWPTD-UHFFFAOYSA-N
Canonical SMILES
CAS
Splash
Other Names 12-Nitro-1,2,3,4,5,6,7,8,9,10-decahydrobenzo[a][12]annulene;
4'-Nitrobenzo-12-crown-4;
1,4,7,10-Benzotetraoxacyclododecin, 2,3,5,6,8,9-hexahydro-12-nitro-

In Other Databases

ChemSpider 608099
PubChem 697932