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2H-Pyrrole-2-methanol, 5-heptyl-3,4-dihydro-, (S)-
SpectraBase Compound ID 1WwHb5PuaqE
InChI InChI=1S/C12H23NO/c1-2-3-4-5-6-7-11-8-9-12(10-14)13-11/h8,12-14H,2-7,9-10H2,1H3/t12-/m0/s1
InChIKey NZQCJNDMTAODST-LBPRGKRZSA-N
Mol Weight 197.32 g/mol
Molecular Formula C12H23NO
Exact Mass 197.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kl1I4z0wFaE
Name 2H-Pyrrole-2-methanol, 5-heptyl-3,4-dihydro-, (S)-
CAS Registry Number 109021-47-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H23NO
InChI InChI=1S/C12H23NO/c1-2-3-4-5-6-7-11-8-9-12(10-14)13-11/h8,12-14H,2-7,9-10H2,1H3/t12-/m0/s1
InChIKey NZQCJNDMTAODST-LBPRGKRZSA-N
Molecular Weight 197.322 g/mol
SMILES N1[C@](CO)(CC=C1CCCCCCC)[H]
SPLASH splash10-01q9-4900000000-e180a213a3783f211f09
Source of Spectrum Y-23-1061-6
Synonyms 2-n-heptyl-(S)-5-hydroxymethyl-L-pyrroline [(2S)-5-heptyl-2,3-dihydro-1H-pyrrol-2-yl]methanol
Wiley ID 1194604