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[3-(8-Benzoyl-8H-1-thia-8-aza-dibenzo[e,h]azulen-2-ylmethoxy)-propyl]dimethylamine
SpectraBase Compound ID 6zt1H1MCMy4
InChI InChI=1S/C29H28N2O2S/c1-30(2)17-10-18-33-20-22-19-25-23-13-6-8-15-26(23)31(29(32)21-11-4-3-5-12-21)27-16-9-7-14-24(27)28(25)34-22/h3-9,11-16,19H,10,17-18,20H2,1-2H3
InChIKey MPWMECPLAJBOGK-UHFFFAOYSA-N
Mol Weight 468.62 g/mol
Molecular Formula C29H28N2O2S
Exact Mass 468.187149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BjZvASoTjYt
Name [3-(8-Benzoyl-8H-1-thia-8-aza-dibenzo[e,h]azulen-2-ylmethoxy)-propyl]dimethylamine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H28N2O2S
InChI InChI=1S/C29H28N2O2S/c1-30(2)17-10-18-33-20-22-19-25-23-13-6-8-15-26(23)31(29(32)21-11-4-3-5-12-21)27-16-9-7-14-24(27)28(25)34-22/h3-9,11-16,19H,10,17-18,20H2,1-2H3
InChIKey MPWMECPLAJBOGK-UHFFFAOYSA-N
Molecular Weight 468.615 g/mol
SMILES c12N(c3c(-c4cc(sc4-c2cccc1)COCCCN(C)C)cccc3)C(=O)c1ccccc1
SPLASH splash10-014i-0001900000-5443cf3480e46b1bb8f9
Source of Spectrum Y-48-862-9b
Wiley ID 1704606