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1,11-Methanobenzo[1,2:4,5]dicycloheptene, 6,11a,12,12a-tetrahydro-
SpectraBase Compound ID F4qf9pe5m7t
InChI InChI=1S/C17H16/c1-2-6-13-10-15-8-4-3-7-14-9-12(5-1)16(13)11-17(14)15/h1-8,16-17H,9-11H2
InChIKey RSIBVVJJEJXIFK-UHFFFAOYSA-N
Mol Weight 220.31 g/mol
Molecular Formula C17H16
Exact Mass 220.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11l0utl9GTW
Name 1,11-Methanobenzo[1,2:4,5]dicycloheptene, 6,11a,12,12a-tetrahydro-
Alternate Name(s) 7,14-Dihydro-1,6 7,14-Dihydro-1,6;8,13-propanediylidene[14annulene 8,13-Propanediylidene[14annulene tetracyclo[11.3.1.0(6,16).0(8,14)]heptadeca-1,3,5,8,10,12-hexaene
CAS Registry Number 109124-02-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16
InChI InChI=1S/C17H16/c1-2-6-13-10-15-8-4-3-7-14-9-12(5-1)16(13)11-17(14)15/h1-8,16-17H,9-11H2
InChIKey RSIBVVJJEJXIFK-UHFFFAOYSA-N
Molecular Weight 220.315 g/mol
SMILES C=12C3C(CC=4C(C(C2)=CC=CC4)C3)=CC=CC1
SPLASH splash10-004i-0920000000-be734557c38196124a45
Source of Spectrum C-109-5002-22
Wiley ID 1220958