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(11R,12R)-9,10-dihydro-9,10-ethano anthracene-11,12-dimethyl bis(2-octynoate)
SpectraBase Compound ID Ehuhes8zm0f
InChI InChI=1S/C34H38O4/c1-3-5-7-9-11-21-31(35)37-23-29-30(24-38-32(36)22-12-10-8-6-4-2)34-27-19-15-13-17-25(27)33(29)26-18-14-16-20-28(26)34/h13-20,29-30,33-34H,3-10,23-24H2,1-2H3/t29-,30-,33?,34?/m0/s1
InChIKey NMFIJSPMEQXLFJ-KHPGBXOLSA-N
Mol Weight 510.7 g/mol
Molecular Formula C34H38O4
Exact Mass 510.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BTdGeUVu4X9
Name (11R,12R)-9,10-dihydro-9,10-ethano anthracene-11,12-dimethyl bis(2-octynoate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H38O4
InChI InChI=1S/C34H38O4/c1-3-5-7-9-11-21-31(35)37-23-29-30(24-38-32(36)22-12-10-8-6-4-2)34-27-19-15-13-17-25(27)33(29)26-18-14-16-20-28(26)34/h13-20,29-30,33-34H,3-10,23-24H2,1-2H3/t29-,30-,33?,34?/m0/s1
InChIKey NMFIJSPMEQXLFJ-KHPGBXOLSA-N
Molecular Weight 510.674 g/mol
SMILES C12[C@]([C@](COC(C#CCCCCC)=O)(C(c3c2cccc3)c2c1cccc2)[H])(COC(C#CCCCCC)=O)[H]
SPLASH splash10-004i-4910000000-f1e241e36ae0f9fb910d
Source of Spectrum QC-22-45-24
Wiley ID 1688610