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3-methoxy-6,7,10,11-tetrapentoxy-2-triphenylenol

View entire compound with spectra: 1 MS (GC)

3-methoxy-6,7,10,11-tetrapentoxy-2-triphenylenol
SpectraBase Compound ID 1om6fiWxfIK
InChI InChI=1S/C39H54O6/c1-6-10-14-18-42-36-24-30-28-22-34(40)35(41-5)23-29(28)31-25-37(43-19-15-11-7-2)39(45-21-17-13-9-4)27-33(31)32(30)26-38(36)44-20-16-12-8-3/h22-27,40H,6-21H2,1-5H3
InChIKey WFXWUHRPYKGVDG-UHFFFAOYSA-N
Mol Weight 618.9 g/mol
Molecular Formula C39H54O6
Exact Mass 618.392039 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LcRBdGVd7qH
Name 3-methoxy-6,7,10,11-tetrapentoxy-2-triphenylenol
Alternate Name(s) 3-methoxy-6,7,10,11-tetrapentoxy-triphenylen-2-ol 6,7,10,11-tetraamoxy-3-methoxy-triphenylen-2-ol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H54O6
InChI InChI=1S/C39H54O6/c1-6-10-14-18-42-36-24-30-28-22-34(40)35(41-5)23-29(28)31-25-37(43-19-15-11-7-2)39(45-21-17-13-9-4)27-33(31)32(30)26-38(36)44-20-16-12-8-3/h22-27,40H,6-21H2,1-5H3
InChIKey WFXWUHRPYKGVDG-UHFFFAOYSA-N
Molecular Weight 618.855 g/mol
SMILES Oc1c(cc2c3c(cc(c(c3)OCCCCC)OCCCCC)c3c(c2c1)cc(c(OCCCCC)c3)OCCCCC)OC
SPLASH splash10-014i-0000009000-b76184bbae3591c8bb2b
Source of Spectrum SO-0-765-2
Wiley ID 864316