For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-(1,3-benzodioxol-4-yl)-2-butylsulfanyl-1,4,5,6-tetrahydrobenzo[h]quinazoline
SpectraBase Compound ID OxaJhLcu0O
InChI InChI=1S/C23H24N2O2S/c1-2-3-13-28-23-24-20-16-8-5-4-7-15(16)11-12-17(20)21(25-23)18-9-6-10-19-22(18)27-14-26-19/h4-10,21H,2-3,11-14H2,1H3,(H,24,25)
InChIKey WEZBJSWKSFTMJC-UHFFFAOYSA-N
Mol Weight 392.52 g/mol
Molecular Formula C23H24N2O2S
Exact Mass 392.155849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID KcsEsgxNDr3
Name 4-(1,3-benzodioxol-4-yl)-2-butylsulfanyl-1,4,5,6-tetrahydrobenzo[h]quinazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H24N2O2S
InChI InChI=1S/C23H24N2O2S/c1-2-3-13-28-23-24-20-16-8-5-4-7-15(16)11-12-17(20)21(25-23)18-9-6-10-19-22(18)27-14-26-19/h4-10,21H,2-3,11-14H2,1H3,(H,24,25)
InChIKey WEZBJSWKSFTMJC-UHFFFAOYSA-N
Instrument Name JEOL 5x102/DA-6000
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.f30
Molecular Weight 392.517 g/mol
SMILES N1C2=C(C(N=C1SCCCC)c1cccc3c1OCO3)CCc1c2cccc1
SPLASH splash10-01p9-0089000000-40c6f8064af009761017
Source of Spectrum ARK-2007-322-2r
Wiley ID 1868979