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N-Benzoyl-2-Azatetracyclo[10,4.0.0(3,11).0(4,10)]hexadeca-1(12),13,15-triene isomer
SpectraBase Compound ID JIsmF1KaibZ
InChI InChI=1S/C22H23NO/c24-22(15-9-3-1-4-10-15)23-19-14-8-7-13-18(19)20-16-11-5-2-6-12-17(16)21(20)23/h1,3-4,7-10,13-14,16-17,20-21H,2,5-6,11-12H2
InChIKey XXRZDJUMRBOSGF-UHFFFAOYSA-N
Mol Weight 317.43 g/mol
Molecular Formula C22H23NO
Exact Mass 317.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AlVOBnxQDDT
Name N-Benzoyl-2-Azatetracyclo[10,4.0.0(3,11).0(4,10)]hexadeca-1(12),13,15-triene isomer
Alternate Name(s) 5-Benzoyl-5,5a,5b,6,7,8,9,10,10a,10b-decahydrocyclohepta[3,4]cyclobuta[1,2-b]indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO
InChI InChI=1S/C22H23NO/c24-22(15-9-3-1-4-10-15)23-19-14-8-7-13-18(19)20-16-11-5-2-6-12-17(16)21(20)23/h1,3-4,7-10,13-14,16-17,20-21H,2,5-6,11-12H2
InChIKey XXRZDJUMRBOSGF-UHFFFAOYSA-N
Molecular Weight 317.432 g/mol
SMILES C12N(c3c(C2C2C1CCCCC2)cccc3)C(=O)c1ccccc1
SPLASH splash10-00di-0190000000-c8bb2449e1cb2412a947
Source of Spectrum I-69-1180-29
Wiley ID 1317904