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Octahydro-3(2H)-isoquinolinone
SpectraBase Compound ID BPXSAWh4hbo
InChI InChI=1S/C9H15NO/c11-9-5-7-3-1-2-4-8(7)6-10-9/h7-8H,1-6H2,(H,10,11)
InChIKey JOLSVXSBWWWNDN-UHFFFAOYSA-N
Mol Weight 153.22 g/mol
Molecular Formula C9H15NO
Exact Mass 153.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GS1Ct8rvHoH
Name Octahydro-3(2H)-isoquinolinone
CAS Registry Number 76097-42-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15NO
InChI InChI=1S/C9H15NO/c11-9-5-7-3-1-2-4-8(7)6-10-9/h7-8H,1-6H2,(H,10,11)
InChIKey JOLSVXSBWWWNDN-UHFFFAOYSA-N
Molecular Weight 153.225 g/mol
SMILES N1C(CC2CCCCC2C1)=O
SPLASH splash10-0f89-9200000000-b444aa9d203e4b732884
Synonyms 2,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-3-one 3(2H)-Isoquinolinone, octahydro-, (4ar-trans)-
Wiley ID 1486399