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Hemiloline
SpectraBase Compound ID 3v3OSGpmyiv
InChI InChI=1S/C7H11NO/c1-2-8-4-5-3-6(8)7(1)9-5/h5-7H,1-4H2/t5-,6-,7-/m0/s1
InChIKey KGWUZRHFQISRKA-ACZMJKKPSA-N
Mol Weight 125.17 g/mol
Molecular Formula C7H11NO
Exact Mass 125.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9LmjNG0KuKD
Name Hemiloline
CAS Registry Number 29079-42-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11NO
InChI InChI=1S/C7H11NO/c1-2-8-4-5-3-6(8)7(1)9-5/h5-7H,1-4H2/t5-,6-,7-/m0/s1
InChIKey KGWUZRHFQISRKA-ACZMJKKPSA-N
Molecular Weight 125.171 g/mol
SMILES [C@@]12(N3CC[C@@]2(O[C@](C3)(C1)[H])[H])[H]
SPLASH splash10-001i-9100000000-afc72c277e27ce62585a
Source of Spectrum J-46-3891-0
Synonyms 2-Oxa-6-azatricyclo[4.2.1.0(3,7)]nonane
Wiley ID 1129419