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Coniine

View entire compound with spectra: 12 NMR, and 8 MS (GC)

Coniine
SpectraBase Compound ID 9jnnTLh5EIy
InChI InChI=1S/C8H17N/c1-2-5-8-6-3-4-7-9-8/h8-9H,2-7H2,1H3
InChIKey NDNUANOUGZGEPO-UHFFFAOYSA-N
Mol Weight 127.23 g/mol
Molecular Formula C8H17N
Exact Mass 127.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BjTuhnegr4R
Name Coniine
CAS Registry Number 458-88-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H17N
InChI InChI=1S/C8H17N/c1-2-5-8-6-3-4-7-9-8/h8-9H,2-7H2,1H3
InChIKey NDNUANOUGZGEPO-UHFFFAOYSA-N
Molecular Weight 127.231 g/mol
SMILES N1CCCCC1CCC
SPLASH splash10-001i-9000000000-f3d008b49e36ae84897a
Source of Spectrum CD-134-0-0
Synonyms (+)-Coniine (S)-(+)-Coniine (S)-Coniine 2-Propylpiperidine Cicutin Cicutine Conicine Coniin d-Conicine Koniin Piperidine, 2-propyl- Piperidine, 2-propyl-, (S)- BRN 0079906 EINECS 207-282-6 HSDB 3474
Wiley ID 1130829