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6,6-bis[4'(S)-4'-benzyloxazolin-2'-yl]dibenzo[a,c]-1,3-cycloheptadiene
SpectraBase Compound ID LG8RtSsHXXx
InChI InChI=1S/C35H32N2O2/c1-3-11-25(12-4-1)19-29-23-38-33(36-29)35(34-37-30(24-39-34)20-26-13-5-2-6-14-26)21-27-15-7-9-17-31(27)32-18-10-8-16-28(32)22-35/h1-18,29-30H,19-24H2/t29-,30-/m0/s1
InChIKey WPGLZGNTZVZYQK-KYJUHHDHSA-N
Mol Weight 512.7 g/mol
Molecular Formula C35H32N2O2
Exact Mass 512.246378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QjPbm0Ckad
Name 6,6-bis[4'(S)-4'-benzyloxazolin-2'-yl]dibenzo[a,c]-1,3-cycloheptadiene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H32N2O2
InChI InChI=1S/C35H32N2O2/c1-3-11-25(12-4-1)19-29-23-38-33(36-29)35(34-37-30(24-39-34)20-26-13-5-2-6-14-26)21-27-15-7-9-17-31(27)32-18-10-8-16-28(32)22-35/h1-18,29-30H,19-24H2/t29-,30-/m0/s1
InChIKey WPGLZGNTZVZYQK-KYJUHHDHSA-N
Molecular Weight 512.653 g/mol
SMILES C1(C2=N[C@@](Cc3ccccc3)(CO2)[H])(C2=N[C@@](Cc3ccccc3)(CO2)[H])Cc2c(cccc2)-c2c(C1)cccc2
SPLASH splash10-03k9-0003690000-fd65b2b99dadd5d2c2e3
Source of Spectrum F-59-1936-5c
Wiley ID 1677418