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

*Links on SpectraBase are not permalinks.
3-[(3 R*,4R)-2',2'-Dimethyl-3'-nitrochroman-4'-yl]-1H-indole
SpectraBase Compound ID LSyEuF7MTKG
InChI InChI=1S/C19H18N2O3/c1-19(2)18(21(22)23)17(13-8-4-6-10-16(13)24-19)14-11-20-15-9-5-3-7-12(14)15/h3-11,17-18,20H,1-2H3/t17-,18+/m0/s1
InChIKey VXOSWBBYVGRYAA-ZWKOTPCHSA-N
Mol Weight 322.36 g/mol
Molecular Formula C19H18N2O3
Exact Mass 322.131742 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 BNrE8qm5FMF
Name 3-[(3 R*,4R)-2',2'-Dimethyl-3'-nitrochroman-4'-yl]-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18N2O3
InChI InChI=1S/C19H18N2O3/c1-19(2)18(21(22)23)17(13-8-4-6-10-16(13)24-19)14-11-20-15-9-5-3-7-12(14)15/h3-11,17-18,20H,1-2H3/t17-,18+/m0/s1
InChIKey VXOSWBBYVGRYAA-ZWKOTPCHSA-N
Molecular Weight 322.364 g/mol
SMILES [nH]1c2c(c(c1)[C@]1([C@@](N(=O)=O)(C(Oc3c1cccc3)(C)C)[H])[H])cccc2
SPLASH splash10-00di-0329000000-039ae16694609ef41c55
Source of Spectrum U1-2009-4513-26a'
Synonyms 3-[(3R,4R)-2,2-dimethyl-3-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]-1H-indole 3-[(3R,4R)-2,2-dimethyl-3-nitro-3,4-dihydrochromen-4-yl]-1H-indole
Wiley ID 1696898