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3-Phenyl-2-oxo-2,3,6,7,8,9-hexahydro-5H-pyrrolo[1,2-a]azepine
SpectraBase Compound ID EoLLgeKLTdE
InChI InChI=1S/C15H17NO/c17-14-11-13-9-5-2-6-10-16(13)15(14)12-7-3-1-4-8-12/h1,3-4,7-8,11,15H,2,5-6,9-10H2
InChIKey UGYIHNRZQKFZFJ-UHFFFAOYSA-N
Mol Weight 227.31 g/mol
Molecular Formula C15H17NO
Exact Mass 227.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fOdOlnQDns
Name 3-Phenyl-2-oxo-2,3,6,7,8,9-hexahydro-5H-pyrrolo[1,2-a]azepine
CAS Registry Number 115860-57-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO
InChI InChI=1S/C15H17NO/c17-14-11-13-9-5-2-6-10-16(13)15(14)12-7-3-1-4-8-12/h1,3-4,7-8,11,15H,2,5-6,9-10H2
InChIKey UGYIHNRZQKFZFJ-UHFFFAOYSA-N
Molecular Weight 227.307 g/mol
SMILES C1=2N(C(C(C2)=O)c2ccccc2)CCCCC1
SPLASH splash10-004i-0390000000-e525cc2da701e9d2aa5c
Source of Spectrum J-53-5684-7
Synonyms 3-Phenyl-6,7,8,9-tetrahydro-3H-pyrrolo[1,2-a]azepin-2(5H)-one
Wiley ID 1228859