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(+-)cis-1,2-Diacetoxy-1,2-dihydrochrysene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(+-)cis-1,2-Diacetoxy-1,2-dihydrochrysene
SpectraBase Compound ID 2bUFNZpsGQF
InChI InChI=1S/C22H18O4/c1-13(23)25-21-12-11-19-18-8-7-15-5-3-4-6-16(15)17(18)9-10-20(19)22(21)26-14(2)24/h3-12,21-22H,1-2H3/t21-,22+/m0/s1
InChIKey DQSVSHWAYAJCTK-FCHUYYIVSA-N
Mol Weight 346.38 g/mol
Molecular Formula C22H18O4
Exact Mass 346.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BG61z5VKX8B
Name cis-1,2-Diacetoxy-1,2-dihydrochrysene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.120509056 u
Formula C22H18O4
InChI InChI=1S/C22H18O4/c1-13(23)25-21-12-11-19-18-8-7-15-5-3-4-6-16(15)17(18)9-10-20(19)22(21)26-14(2)24/h3-12,21-22H,1-2H3/t21-,22+/m0/s1
InChIKey DQSVSHWAYAJCTK-FCHUYYIVSA-N
Molecular Weight 346.382 g/mol
SMILES C1=2C(=CC=CC2)C2=C(C=C1)C1=C([C@]([C@](C=C1)(OC(=O)C)[H])(OC(=O)C)[H])C=C2