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(1S,2R)-2-ethyl-1-(nitromethyl)-1H-pyrrolo[1,2-a]indol-3(2H)-one
SpectraBase Compound ID 26iZjteFhyy
InChI InChI=1S/C14H14N2O3/c1-2-10-11(8-15(18)19)13-7-9-5-3-4-6-12(9)16(13)14(10)17/h3-7,10-11H,2,8H2,1H3/t10-,11-/m1/s1
InChIKey XSSDUIKGSJASDJ-GHMZBOCLSA-N
Mol Weight 258.28 g/mol
Molecular Formula C14H14N2O3
Exact Mass 258.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3b8XGAmuRs
Name (1S,2R)-2-ethyl-1-(nitromethyl)-1H-pyrrolo[1,2-a]indol-3(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O3
InChI InChI=1S/C14H14N2O3/c1-2-10-11(8-15(18)19)13-7-9-5-3-4-6-12(9)16(13)14(10)17/h3-7,10-11H,2,8H2,1H3/t10-,11-/m1/s1
InChIKey XSSDUIKGSJASDJ-GHMZBOCLSA-N
Literature Reference DOI 10.1002/anie.201305957
Molecular Weight 258.277 g/mol
SMILES c1c2[n](C([C@](CC)([C@]2(C[N+](=O)[O-])[H])[H])=O)c2c1cccc2
SPLASH splash10-090r-0890000000-d36fc22af0986355bbef
Source of Spectrum ACI-52-SM-3k
Synonyms (1S,2R)-2-ethyl-1-(nitromethyl)-1,2-dihydro-3H-pyrrolo[1,2-a]indol-3-one
Wiley ID 1781874