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7,7-Propylene-bis{ 6',7',8',9',14',15-hexahydro-5H-benz[d]indolo[2,3-g]azecine}
SpectraBase Compound ID FhJo89rvBiV
InChI InChI=1S/C41H44N4/c1-3-12-32-28-40-36(34-14-5-7-16-38(34)42-40)20-26-44(24-18-30(32)10-1)22-9-23-45-25-19-31-11-2-4-13-33(31)29-41-37(21-27-45)35-15-6-8-17-39(35)43-41/h1-8,10-17,42-43H,9,18-29H2
InChIKey PZKLBZAQLYGCHB-UHFFFAOYSA-N
Mol Weight 592.8 g/mol
Molecular Formula C41H44N4
Exact Mass 592.356597 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6VRYn8da2Rl
Name 7,7-Propylene-bis{ 6',7',8',9',14',15-hexahydro-5H-benz[d]indolo[2,3-g]azecine}
Alternate Name(s) 7-[3-(5,6,8,9,14,15-hexahydro-7H-indolo[3,2-f][3]benzazecin-7-yl)propyl]-6,7,8,9,14,15-hexahydro-5H-indolo[3,2-f][3]benzazecine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C41H44N4
InChI InChI=1S/C41H44N4/c1-3-12-32-28-40-36(34-14-5-7-16-38(34)42-40)20-26-44(24-18-30(32)10-1)22-9-23-45-25-19-31-11-2-4-13-33(31)29-41-37(21-27-45)35-15-6-8-17-39(35)43-41/h1-8,10-17,42-43H,9,18-29H2
InChIKey PZKLBZAQLYGCHB-UHFFFAOYSA-N
Molecular Weight 592.831 g/mol
SMILES [nH]1c2ccccc2c2CCN(CCCN3CCc4c(Cc5c(CC3)cccc5)[nH]c3c4cccc3)CCc3c(Cc12)cccc3
SPLASH splash10-0002-0900000000-1495f5ca19e7d50c9b60
Source of Spectrum D9-335-371-7
Wiley ID 1551009