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5,5'-Bi-5H-dibenzo[a,d]cycloheptene, 10,10',11,11'-tetrahydro-10,10',11,11'-bis(methoxymethyl)-, [10R-[5.alpha.(10'R*,11'R*),10.alpha.,11.beta.]]-
SpectraBase Compound ID YuNHxwhUA9
InChI InChI=1S/C38H42O4/c1-39-21-33-25-13-5-9-17-29(25)37(30-18-10-6-14-26(30)34(33)22-40-2)38-31-19-11-7-15-27(31)35(23-41-3)36(24-42-4)28-16-8-12-20-32(28)38/h5-20,33-38H,21-24H2,1-4H3/t33-,34-,35?,36?,38?/m0/s1
InChIKey BSHAJDZRFBWTPH-PBUOPWIYSA-N
Mol Weight 562.8 g/mol
Molecular Formula C38H42O4
Exact Mass 562.30831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 74ugPuDQypq
Name 5,5'-Bi-5H-dibenzo[a,d]cycloheptene, 10,10',11,11'-tetrahydro-10,10',11,11'-bis(methoxymethyl)-, [10R-[5.alpha.(10'R*,11'R*),10.alpha.,11.beta.]]-
CAS Registry Number 115491-99-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H42O4
InChI InChI=1S/C38H42O4/c1-39-21-33-25-13-5-9-17-29(25)37(30-18-10-6-14-26(30)34(33)22-40-2)38-31-19-11-7-15-27(31)35(23-41-3)36(24-42-4)28-16-8-12-20-32(28)38/h5-20,33-38H,21-24H2,1-4H3/t33-,34-,35?,36?,38?/m0/s1
InChIKey BSHAJDZRFBWTPH-PBUOPWIYSA-N
Molecular Weight 562.750 g/mol
SMILES C1(C2c3c(C(COC)C(c4c2cccc4)COC)cccc3)c2c([C@](COC)([C@](c3c1cccc3)(COC)[H])[H])cccc2
SPLASH splash10-0006-0900000000-82d4f5b9d09046a504dd
Source of Spectrum F-43-4961-48
Synonyms 2-[(9R,10R)-9,10-bis(methoxymethyl)tricyclo[9.4.0.0(3,8)]pentadeca-1(15),3,5,7,11,13-hexaen-2-yl]-9,10-bis(methoxymethyl)tricyclo[9.4.0.0(3,8)]pentadeca-1(11),3,5,7,12,14-hexaene 5,5'-bi[(10R,11R)-10,11-bismethoxymethyl-dibenzo[a,d]cycloheptenyl]
Wiley ID 1406992