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(1alpha,2beta,3alpha,6alpha,7beta,8alpha)-4,5;9,10-Dipyridazino[4,5]tetracyclo[6.2.1.1(3,6).0(2,7)]dodeca-4,9-diene
SpectraBase Compound ID 6uzE7qKIB9z
InChI InChI=1S/C16H14N4/c1-7-11-3-17-18-4-12(11)8(1)16-10-2-9(15(7)16)13-5-19-20-6-14(10)13/h3-10,15-16H,1-2H2/t7-,8+,9+,10-,15+,16-
InChIKey QJISRFNCZCOHNV-XDMSWBKZSA-N
Mol Weight 262.32 g/mol
Molecular Formula C16H14N4
Exact Mass 262.121846 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nYyFYU0fRG
Name (1alpha,2beta,3alpha,6alpha,7beta,8alpha)-4,5;9,10-Dipyridazino[4,5]tetracyclo[6.2.1.1(3,6).0(2,7)]dodeca-4,9-diene
Alternate Name(s) (5R,5as,6S,11R,11as,12S)-5,5a,6,11,11a,12-hexahydro-5,12:6,11-dimethanophthalazino[6,7-g]phthalazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N4
InChI InChI=1S/C16H14N4/c1-7-11-3-17-18-4-12(11)8(1)16-10-2-9(15(7)16)13-5-19-20-6-14(10)13/h3-10,15-16H,1-2H2/t7-,8+,9+,10-,15+,16-
InChIKey QJISRFNCZCOHNV-XDMSWBKZSA-N
Literature Reference DOI 10.1002/cber.19861191121
Molecular Weight 262.316 g/mol
SMILES c12[C@]3([C@]4([C@@]([C@@](c2cnnc1)(C3)[H])([C@@]1(c2c([C@]4(C1)[H])cnnc2)[H])[H])[H])[H]
SPLASH splash10-03xu-2940000000-a6ff3c329c4a870c41b9
Source of Spectrum K-119-3468-65
Wiley ID 1794447