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8-(4,5-Cyclohexeno-1,3-benzodithiol-2-ylidene)-3,3-diphenyl[3H]naphtho[2,1-b]pyrane
SpectraBase Compound ID 8s2WhQAV065
InChI InChI=1S/C33H26OS2/c1-3-9-25(10-4-1)33(26-11-5-2-6-12-26)20-19-28-27-17-15-23(21-24(27)16-18-29(28)34-33)22-32-35-30-13-7-8-14-31(30)36-32/h1-6,9-12,15-22H,7-8,13-14H2
InChIKey DAJMDDYVRMUPFC-UHFFFAOYSA-N
Mol Weight 502.7 g/mol
Molecular Formula C33H26OS2
Exact Mass 502.142508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3HOHH2D02ko
Name 8-(4,5-Cyclohexeno-1,3-benzodithiol-2-ylidene)-3,3-diphenyl[3H]naphtho[2,1-b]pyrane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H26OS2
InChI InChI=1S/C33H26OS2/c1-3-9-25(10-4-1)33(26-11-5-2-6-12-26)20-19-28-27-17-15-23(21-24(27)16-18-29(28)34-33)22-32-35-30-13-7-8-14-31(30)36-32/h1-6,9-12,15-22H,7-8,13-14H2
InChIKey DAJMDDYVRMUPFC-UHFFFAOYSA-N
Molecular Weight 502.690 g/mol
SMILES C1(SC=2CCCCC2S1)=Cc1cc2ccc3OC(c4ccccc4)(c4ccccc4)C=Cc3c2cc1
SPLASH splash10-0a4i-0009020000-c771c432e908dbf8ce81
Source of Spectrum KC-61-427-2
Wiley ID 1627061