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

*Links on SpectraBase are not permalinks.
2-Methyl-3-[(3 R*,4S)-2',2'-dimethyl-3'-nitrochroman-4'-yl]-1H-indole
SpectraBase Compound ID 69TqN0so5Ch
InChI InChI=1S/C20H20N2O3/c1-12-17(13-8-4-6-10-15(13)21-12)18-14-9-5-7-11-16(14)25-20(2,3)19(18)22(23)24/h4-11,18-19,21H,1-3H3/t18-,19-/m1/s1
InChIKey PWQDOJMHLXVMKL-RTBURBONSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 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 8McHjRM3Zjc
Name 2-Methyl-3-[(3 R*,4S)-2',2'-dimethyl-3'-nitrochroman-4'-yl]-1H-indole
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-12-17(13-8-4-6-10-15(13)21-12)18-14-9-5-7-11-16(14)25-20(2,3)19(18)22(23)24/h4-11,18-19,21H,1-3H3/t18-,19-/m1/s1
InChIKey PWQDOJMHLXVMKL-RTBURBONSA-N
Molecular Weight 336.391 g/mol
SMILES [nH]1c2c(c(c1C)[C@@]1([C@@](N(=O)=O)(C(Oc3c1cccc3)(C)C)[H])[H])cccc2
SPLASH splash10-00dr-0098000000-c11a36405a17a5204fcd
Source of Spectrum U1-2009-4513-27a
Synonyms 3-[(3R,4S)-2,2-dimethyl-3-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]-2-methyl-1H-indole 3-[(3R,4S)-2,2-dimethyl-3-nitro-3,4-dihydrochromen-4-yl]-2-methyl-1H-indole
Wiley ID 1696897