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5-Chloro-10-oxo-3,9-diazapentacyclo[12.3.1.1(12,16).0(2,11).0(3,8)]nonadeca-2(11),4,6,8-tetraene
SpectraBase Compound ID 2wPAXgOhv2Y
InChI InChI=1S/C17H17ClN2O/c18-13-1-2-14-19-17(21)15-11-4-9-3-10(5-11)7-12(6-9)16(15)20(14)8-13/h1-2,8-12H,3-7H2/t9-,10+,11-,12+
InChIKey JHPPZXLTCHJRNJ-BKUVIOGVSA-N
Mol Weight 300.79 g/mol
Molecular Formula C17H17ClN2O
Exact Mass 300.102941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ArRJiFfMjwF
Name 5-Chloro-10-oxo-3,9-diazapentacyclo[12.3.1.1(12,16).0(2,11).0(3,8)]nonadeca-2(11),4,6,8-tetraene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClN2O
InChI InChI=1S/C17H17ClN2O/c18-13-1-2-14-19-17(21)15-11-4-9-3-10(5-11)7-12(6-9)16(15)20(14)8-13/h1-2,8-12H,3-7H2/t9-,10+,11-,12+
InChIKey JHPPZXLTCHJRNJ-BKUVIOGVSA-N
Molecular Weight 300.789 g/mol
SMILES [C@]12(C=3N4C=C(C=CC4=NC(C3[C@@]3(C[C@@](C[C@](C1)(C3)[H])(C2)[H])[H])=O)Cl)[H]
SPLASH splash10-0udi-2096000000-bbc912497c2e1204078b
Source of Spectrum AJ-41-196-6
Synonyms 5-Chloro-3,9-diazapentacyclo[12.3.1.1(12,16).0(2,11).0(3,8)]nonadeca-2(11),4,6,8-tetraen-10-one
Wiley ID 1567350