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5-(6,11-dioxo-6,11-dihydro-5H-dibenzo[b,e]azepin-5-yl)pentanenitrile
SpectraBase Compound ID BZAdv1S9mIc
InChI InChI=1S/C19H16N2O2/c20-12-6-1-7-13-21-17-11-5-4-10-16(17)18(22)14-8-2-3-9-15(14)19(21)23/h2-5,8-11H,1,6-7,13H2
InChIKey PQKZKAIJYAZGJP-UHFFFAOYSA-N
Mol Weight 304.35 g/mol
Molecular Formula C19H16N2O2
Exact Mass 304.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHNXE23tEsd
Name 5-(6,11-dioxo-6,11-dihydro-5H-dibenzo[b,e]azepin-5-yl)pentanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16N2O2
InChI InChI=1S/C19H16N2O2/c20-12-6-1-7-13-21-17-11-5-4-10-16(17)18(22)14-8-2-3-9-15(14)19(21)23/h2-5,8-11H,1,6-7,13H2
InChIKey PQKZKAIJYAZGJP-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C6QO00036C
Molecular Weight 304.349 g/mol
SMILES C(CCCCN1c2c(C(c3c(C1=O)cccc3)=O)cccc2)#N
SPLASH splash10-0ab9-1290000000-9b0958e0c0f6705abef2
Source of Spectrum OCF-3-614/SM8-7h
Wiley ID 1804826