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

*Links on SpectraBase are not permalinks.
4-Nitro-5-(phenylsulfinyl)methyl-1H-1,3,4,5-tetrahydrobenz[cd]indole
SpectraBase Compound ID KdhABStCbeX
InChI InChI=1S/C18H16N2O3S/c21-20(22)17-9-12-10-19-16-8-4-7-14(18(12)16)15(17)11-24(23)13-5-2-1-3-6-13/h1-8,10,15,17,19H,9,11H2
InChIKey XLFOMQCWBAIUGT-UHFFFAOYSA-N
Mol Weight 340.4 g/mol
Molecular Formula C18H16N2O3S
Exact Mass 340.088164 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 DZNOG0EZKub
Name 4-Nitro-5-(phenylsulfinyl)methyl-1H-1,3,4,5-tetrahydrobenz[cd]indole
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N2O3S
InChI InChI=1S/C18H16N2O3S/c21-20(22)17-9-12-10-19-16-8-4-7-14(18(12)16)15(17)11-24(23)13-5-2-1-3-6-13/h1-8,10,15,17,19H,9,11H2
InChIKey XLFOMQCWBAIUGT-UHFFFAOYSA-N
Molecular Weight 340.397 g/mol
SMILES [nH]1cc2c3c1cccc3C(C(C2)N(=O)=O)CS(=O)c1ccccc1
SPLASH splash10-066r-0990000000-137331c945a7660fe5da
Source of Spectrum U-1997-1977-51
Synonyms (4-nitro-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl)methyl phenyl sulfoxide 4-Nitro-5-[(phenylsulfinyl)methyl]-1,3,4,5-tetrahydrobenzo[cd]indole
Wiley ID 770148