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(5.alpha.,6.beta.,7.beta.,12.alpha.)-2,9-bis-[(E)-cyclohexylmethylene]-6,12-bis(4-nitrophenyl)dispiro[4.1.4.1]dodecane-1,8-dione
SpectraBase Compound ID BWiwjsHRv1l
InChI InChI=1S/C38H42N2O6/c41-35-29(23-25-7-3-1-4-8-25)19-21-37(35)33(27-11-15-31(16-12-27)39(43)44)38(34(37)28-13-17-32(18-14-28)40(45)46)22-20-30(36(38)42)24-26-9-5-2-6-10-26/h11-18,23-26,33-34H,1-10,19-22H2/b29-23+,30-24+/t33-,34-,37-,38-
InChIKey SFTWIVQBCUJUAM-LRFOUVGWSA-N
Mol Weight 622.8 g/mol
Molecular Formula C38H42N2O6
Exact Mass 622.304287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KsLVxxpIfxF
Name (5.alpha.,6.beta.,7.beta.,12.alpha.)-2,9-bis-[(E)-cyclohexylmethylene]-6,12-bis(4-nitrophenyl)dispiro[4.1.4.1]dodecane-1,8-dione
CAS Registry Number 106115-65-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H42N2O6
InChI InChI=1S/C38H42N2O6/c41-35-29(23-25-7-3-1-4-8-25)19-21-37(35)33(27-11-15-31(16-12-27)39(43)44)38(34(37)28-13-17-32(18-14-28)40(45)46)22-20-30(36(38)42)24-26-9-5-2-6-10-26/h11-18,23-26,33-34H,1-10,19-22H2/b29-23+,30-24+/t33-,34-,37-,38-
InChIKey SFTWIVQBCUJUAM-LRFOUVGWSA-N
Molecular Weight 622.762 g/mol
SMILES [C@]12([C@](c3ccc(N(=O)=O)cc3)([H])[C@@]3([C@@]1(c1ccc(N(=O)=O)cc1)[H])C(\C(=C\C1CCCCC1)CC3)=O)C(\C(=C\C1CCCCC1)CC2)=O
SPLASH splash10-03di-0009001000-cda3fe490161547e00de
Source of Spectrum K-120-392-8
Synonyms (2E,9E)-2,9-bis(cyclohexylmethylene)-6,12-bis(4-nitrophenyl)dispiro[4.1.4.1]dodecane-1,8-dione
Wiley ID 1411690