7,8: 12,13-Dibenzopentacyclo[7.4.0.0(2,6).0(3,11).0(5,10)] trideca-7,12-diene

SpectraBase Compound ID	6RQ2mRLDlaL
InChI	InChI=1S/C21H18/c1-3-7-12-10(5-1)16-14-9-15-17-11-6-2-4-8-13(11)19(20(15)16)18(12)21(14)17/h1-8,14-21H,9H2/t14-,15-,16-,17-,18-,19-,20+,21+/m0/s1
InChIKey	MDYOLBPQHOXJJQ-YVFDZHEOSA-N Google Search
Mol Weight	270.37 g/mol
Molecular Formula	C21H18
Exact Mass	270.140851 g/mol

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SpectraBase Spectrum ID	JP8BQSPtmS3
Name	7,8: 12,13-Dibenzopentacyclo[7.4.0.0(2,6).0(3,11).0(5,10)] trideca-7,12-diene
Alternate Name(s)	heptacyclo[11.8.0.0(2,11).0(3,15).0(4,9).0(10,14).0(16,21)]henicosa-4,6,8,16,18,20-hexaene
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H18
InChI	InChI=1S/C21H18/c1-3-7-12-10(5-1)16-14-9-15-17-11-6-2-4-8-13(11)19(20(15)16)18(12)21(14)17/h1-8,14-21H,9H2/t14-,15-,16-,17-,18-,19-,20+,21+/m0/s1
InChIKey	MDYOLBPQHOXJJQ-YVFDZHEOSA-N
Molecular Weight	270.375 g/mol
SMILES	[C@@]12([C@]3([C@]4([C@@](c5c2cccc5)([C@]2([C@@]1([C@]([C@@]4(C2)[H])(c1ccccc31)[H])[H])[H])[H])[H])[H])[H]
SPLASH	splash10-0006-0900000000-eeaa93658c3b725579e1
Source of Spectrum	K-126-2292-0
Wiley ID	1275026