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Coniine

View entire compound with spectra: 5 MS (GC)

Coniine
SpectraBase Compound ID GlIOYgFX5NP
InChI InChI=1S/C8H17N/c1-2-5-8-6-3-4-7-9-8/h8-9H,2-7H2,1H3/t8-/m0/s1
InChIKey NDNUANOUGZGEPO-QMMMGPOBSA-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 6RZ0zVTkQiB
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/t8-/m0/s1
InChIKey NDNUANOUGZGEPO-QMMMGPOBSA-N
Molecular Weight 127.231 g/mol
SMILES N1CCCC[C@@]1(CCC)[H]
SPLASH splash10-001i-9000000000-88f882cb4aa1b0e05875
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 1508134