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Hexaaza-hexacyclooctadecane
SpectraBase Compound ID II1cpUSv94N
InChI InChI=1S/C12H20N6/c1-5-13-6-2-10-15(13)9(1)17-11-3-7-14-8-4-12(16(11)14)18(10)17/h9-12H,1-8H2
InChIKey QRQGJJKSSQUYIV-UHFFFAOYSA-N
Mol Weight 248.33 g/mol
Molecular Formula C12H20N6
Exact Mass 248.174945 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8R02F91cT8q
Name Hexaaza-hexacyclooctadecane
CAS Registry Number 96557-42-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20N6
InChI InChI=1S/C12H20N6/c1-5-13-6-2-10-15(13)9(1)17-11-3-7-14-8-4-12(16(11)14)18(10)17/h9-12H,1-8H2
InChIKey QRQGJJKSSQUYIV-UHFFFAOYSA-N
Instrument Name Bruker WM-360
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6