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7,8,9,10-Tetradehydro-1,6:11,16-dimethano[23]annulen-19-one
SpectraBase Compound ID 9FlJ3naoa97
InChI InChI=1S/C25H18O/c26-25-16-8-7-14-22-11-2-1-9-21(19-22)10-3-4-12-23-13-5-6-15-24(20-23)17-18-25/h1-2,5-9,11,13-18H,19-20H2/b14-7-,16-8-,18-17-
InChIKey KPTXHSSIOGIMBI-NEMJYOBISA-N
Mol Weight 334.42 g/mol
Molecular Formula C25H18O
Exact Mass 334.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5dlBpagWvyZ
Name 7,8,9,10-Tetradehydro-1,6:11,16-dimethano[23]annulen-19-one
Alternate Name(s) tricyclo[17.4.1.1(6,11)]pentacosa-1(23),6,8,10,12,15,17,19,21-nonaene-2,4-diyn-14-one
Comments Less than 3 mono-isotopic peaks
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Formula C25H18O
InChI InChI=1S/C25H18O/c26-25-16-8-7-14-22-11-2-1-9-21(19-22)10-3-4-12-23-13-5-6-15-24(20-23)17-18-25/h1-2,5-9,11,13-18H,19-20H2/b14-7-,16-8-,18-17-
InChIKey KPTXHSSIOGIMBI-NEMJYOBISA-N
Molecular Weight 334.418 g/mol
SMILES C#1C#CC2=CC=CC=C(C2)\C=C/C(=O)\C=C/C=C\C=2CC(C1)=CC=CC2
SPLASH splash10-0019-0098000000-78da20ea01a35826eb36
Source of Spectrum KC-0-3035-13
Wiley ID 784717