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Isocyano-1,3,3-triphenylindan-2-one
SpectraBase Compound ID DgBOgBqFdbR
InChI InChI=1S/C28H19NO/c1-29-28(23-17-9-4-10-18-23)25-20-12-11-19-24(25)27(26(28)30,21-13-5-2-6-14-21)22-15-7-3-8-16-22/h2-20H
InChIKey VJKABWRSMSNQCU-UHFFFAOYSA-N
Mol Weight 385.47 g/mol
Molecular Formula C28H19NO
Exact Mass 385.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6VrJJQi9kk1
Name Isocyano-1,3,3-triphenylindan-2-one
Alternate Name(s) 1-isocyano-1,3,3-triphenyl-2,3-dihydro-1H-inden-2-one 1-isocyano-1,3,3-triphenyl-2-indenone 1-isocyano-1,3,3-triphenylinden-2-one 1-isocyano-1,3,3-triphenyl-inden-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H19NO
InChI InChI=1S/C28H19NO/c1-29-28(23-17-9-4-10-18-23)25-20-12-11-19-24(25)27(26(28)30,21-13-5-2-6-14-21)22-15-7-3-8-16-22/h2-20H
InChIKey VJKABWRSMSNQCU-UHFFFAOYSA-N
Molecular Weight 385.466 g/mol
SMILES C1(C(C(c2ccccc2)(c2ccccc2)c2c1cccc2)=O)([N+]#[C-])c1ccccc1
SPLASH splash10-0a59-0029000000-463ca87f1bf1a06214d0
Source of Spectrum U1-1999-561-3
Wiley ID 752690