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2,16:3,10-Diethano-15,11-metheno-11H-tribenzo[a,e,i]cyclopentadecene, 5,6,20,21-tetrahydro-
SpectraBase Compound ID 8h1fnvOEFm5
InChI InChI=1S/C32H28/c1-4-21-10-14-25-18-26-15-11-22(5-1)31(21)29-8-3-9-30(20-29)32-23-6-2-7-24(32)13-17-28(26)19-27(25)16-12-23/h1-9,18-20H,10-17H2
InChIKey ZLRWIVDMLKNTJU-UHFFFAOYSA-N
Mol Weight 412.6 g/mol
Molecular Formula C32H28
Exact Mass 412.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqMmvHWqVQq
Name 2,16:3,10-Diethano-15,11-metheno-11H-tribenzo[a,e,i]cyclopentadecene, 5,6,20,21-tetrahydro-
CAS Registry Number 116129-69-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H28
InChI InChI=1S/C32H28/c1-4-21-10-14-25-18-26-15-11-22(5-1)31(21)29-8-3-9-30(20-29)32-23-6-2-7-24(32)13-17-28(26)19-27(25)16-12-23/h1-9,18-20H,10-17H2
InChIKey ZLRWIVDMLKNTJU-UHFFFAOYSA-N
Molecular Weight 412.576 g/mol
SMILES c12-c3c4CCc5c6CCc7c(-c(c2)ccc1)c(CCc(c(CCc3ccc4)c5)c6)ccc7
SPLASH splash10-03e9-0090600000-36b9eb25e8b614c8c36a
Source of Spectrum J-55-890-43
Synonyms 7,12-Dihydro-14H-1,9:10,18-bis(methanomethano)-19,23-metheno-5H-tribenzo[c,H,o][1,6]cyclopentadecine Heptacyclo[17.8.2.2(9,18).1(3,7).0(2,24).0(8,13).0(16,21)]dotriaconta-1,3(32),4,6,8,10,12,16,18,20,24,26-dodecaene
Wiley ID 1374916