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(2S*,3aR*,6aR*)-2-Phenyloctahydrocyclopenta-[b]-pyrrole
SpectraBase Compound ID 2SFnhcnUQTZ
InChI InChI=1S/C13H17N/c1-2-5-10(6-3-1)13-9-11-7-4-8-12(11)14-13/h1-3,5-6,11-14H,4,7-9H2/t11-,12-,13+/m1/s1
InChIKey YLEIWBYZBMWGCI-UPJWGTAASA-N
Mol Weight 187.29 g/mol
Molecular Formula C13H17N
Exact Mass 187.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 27LkY6VPWxu
Name (2S*,3aR*,6aR*)-2-Phenyloctahydrocyclopenta-[b]-pyrrole
Appearance Orange residue
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Exact Mass 187.136099551 u
Formula C13H17N
InChI InChI=1S/C13H17N/c1-2-5-10(6-3-1)13-9-11-7-4-8-12(11)14-13/h1-3,5-6,11-14H,4,7-9H2/t11-,12-,13+/m1/s1
InChIKey YLEIWBYZBMWGCI-UPJWGTAASA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0003.811
Molecular Weight 187.286 g/mol
Quality 238
SMILES N1[C@@](C[C@@]2([C@]1(CCC2)[H])[H])(C1=CC=CC=C1)[H]
SPLASH splash10-0ly6-1900000000-711a73de88867acf41c0
Sample Comments Major isomer
Source of Spectrum ARK-2002-105-18a (DOI: 10.3998/ark.5550190.0003.811)
Wiley ID 1904779