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3,3-Pentamethylene-tetrahydro-3H-1,2-benzodiazepine
SpectraBase Compound ID CuPQiM1i7FI
InChI InChI=1S/C12H18N2/c1-4-8-12(9-5-1)10-6-2-3-7-11(10)13-14-12/h1-9H2
InChIKey YSNLUTKKADAHSE-UHFFFAOYSA-N
Mol Weight 190.29 g/mol
Molecular Formula C12H18N2
Exact Mass 190.146999 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3upjYzqthZG
Name 3,3-Pentamethylene-tetrahydro-3H-1,2-benzodiazepine
CAS Registry Number 28748-97-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18N2
InChI InChI=1S/C12H18N2/c1-4-8-12(9-5-1)10-6-2-3-7-11(10)13-14-12/h1-9H2
InChIKey YSNLUTKKADAHSE-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference J.T. Sharp, R.H. Findlay, P.B. Thorogood, J. Chem. Soc. Perkin I 102 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3