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[4-.alpha.,5-.beta.]-1,3,4,5-Tetrahydro-4-N-formylmethylamino-5-(hydroxycarbonyl)methylbenz[c,d]indole
SpectraBase Compound ID 56ed3bvmUnn
InChI InChI=1S/C15H16N2O3/c1-17(8-18)13-5-9-7-16-12-4-2-3-10(15(9)12)11(13)6-14(19)20/h2-4,7-8,11,13,16H,5-6H2,1H3,(H,19,20)/t11-,13-/m1/s1
InChIKey FKYXCLSGJHRYFS-DGCLKSJQSA-N
Mol Weight 272.3 g/mol
Molecular Formula C15H16N2O3
Exact Mass 272.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NYDq69B9jH
Name [4-.alpha.,5-.beta.]-1,3,4,5-Tetrahydro-4-N-formylmethylamino-5-(hydroxycarbonyl)methylbenz[c,d]indole
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Formula C15H16N2O3
InChI InChI=1S/C15H16N2O3/c1-17(8-18)13-5-9-7-16-12-4-2-3-10(15(9)12)11(13)6-14(19)20/h2-4,7-8,11,13,16H,5-6H2,1H3,(H,19,20)/t11-,13-/m1/s1
InChIKey FKYXCLSGJHRYFS-DGCLKSJQSA-N
Molecular Weight 272.304 g/mol
SMILES [nH]1c2cccc3c2c(C[C@]([C@@]3(CC(=O)O)[H])(N(C=O)C)[H])c1
SPLASH splash10-0udi-0900000000-5792b1e01f510ef0cce0
Source of Spectrum Y-29-457-0
Synonyms {(4R,5R)-4-[formyl(methyl)amino]-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl}acetic acid 2-[(4R,5R)-4-[methanoyl(methyl)amino]-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl]ethanoic acid
Wiley ID 1276132