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2,3,6,7,10,11-Hexapentyloxytriphenylene

View entire compound with spectra: 1 MS (GC)

2,3,6,7,10,11-Hexapentyloxytriphenylene
SpectraBase Compound ID JzJDuGo4IoO
InChI InChI=1S/C48H72O6/c1-7-13-19-25-49-43-31-37-38(32-44(43)50-26-20-14-8-2)40-34-46(52-28-22-16-10-4)48(54-30-24-18-12-6)36-42(40)41-35-47(53-29-23-17-11-5)45(33-39(37)41)51-27-21-15-9-3/h31-36H,7-30H2,1-6H3
InChIKey LWHHLYFBQPYIFI-UHFFFAOYSA-N
Mol Weight 745.1 g/mol
Molecular Formula C48H72O6
Exact Mass 744.53289 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID vAoCBZVlSh
Name 2,3,6,7,10,11-Hexapentyloxytriphenylene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H72O6
InChI InChI=1S/C48H72O6/c1-7-13-19-25-49-43-31-37-38(32-44(43)50-26-20-14-8-2)40-34-46(52-28-22-16-10-4)48(54-30-24-18-12-6)36-42(40)41-35-47(53-29-23-17-11-5)45(33-39(37)41)51-27-21-15-9-3/h31-36H,7-30H2,1-6H3
InChIKey LWHHLYFBQPYIFI-UHFFFAOYSA-N
Molecular Weight 745.098 g/mol
SMILES c12c(c3c(c4c2cc(c(c4)OCCCCC)OCCCCC)cc(c(c3)OCCCCC)OCCCCC)cc(c(c1)OCCCCC)OCCCCC
SPLASH splash10-0002-0005103900-2a7e4afda8a80009831e
Source of Spectrum SO-0-478-2
Synonyms 2,3,6,7,10,11-Hexaamoxytriphenylene 2,3,6,7,10,11-Hexakis(pentyloxy)triphenylene 2,3,6,7,10,11-Hexapentoxytriphenylene
Wiley ID 1544920