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1,4,7-Trihydrocyclononano[2,3-b:5,6-b:8,9-b]tri-1-allyl-5,6-methylenedioxyindole
SpectraBase Compound ID KfNETgqIOxT
InChI InChI=1S/C39H33N3O6/c1-4-7-40-28-10-23-26-14-35-38(47-20-44-35)17-32(26)42(9-6-3)30(23)12-24-27-15-36-39(48-21-45-36)18-33(27)41(8-5-2)29(24)11-22(28)25-13-34-37(16-31(25)40)46-19-43-34/h4-6,13-18H,1-3,7-12,19-21H2
InChIKey KMHFLAHVRSGYRY-UHFFFAOYSA-N
Mol Weight 639.7 g/mol
Molecular Formula C39H33N3O6
Exact Mass 639.236936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ak5jfYmbkx
Name 1,4,7-Trihydrocyclononano[2,3-b:5,6-b:8,9-b]tri-1-allyl-5,6-methylenedioxyindole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H33N3O6
InChI InChI=1S/C39H33N3O6/c1-4-7-40-28-10-23-26-14-35-38(47-20-44-35)17-32(26)42(9-6-3)30(23)12-24-27-15-36-39(48-21-45-36)18-33(27)41(8-5-2)29(24)11-22(28)25-13-34-37(16-31(25)40)46-19-43-34/h4-6,13-18H,1-3,7-12,19-21H2
InChIKey KMHFLAHVRSGYRY-UHFFFAOYSA-N
Molecular Weight 639.708 g/mol
SMILES c12c(c3cc4OCOc4cc3[n]2CC=C)Cc2c(c3cc4OCOc4cc3[n]2CC=C)Cc2c(C1)c1c(cc3c(c1)OCO3)[n]2CC=C
SPLASH splash10-01sc-0234319000-ce69fc1e90dce7dce8ce
Source of Spectrum F-65-5982-29
Wiley ID 1680151