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1,4-Dihydrobenzo[e][1,2,4]triazepin-5-one
SpectraBase Compound ID 1Qj8PRhomxL
InChI InChI=1S/C8H7N3O/c12-8-6-3-1-2-4-7(6)9-5-10-11-8/h1-5H,(H,9,10)(H,11,12)
InChIKey IBGDNKGFQNPQDK-UHFFFAOYSA-N
Mol Weight 161.16 g/mol
Molecular Formula C8H7N3O
Exact Mass 161.058912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5iKsWYDP9Yp
Name 1,4-Dihydrobenzo[e][1,2,4]triazepin-5-one
CAS Registry Number 57711-25-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7N3O
InChI InChI=1S/C8H7N3O/c12-8-6-3-1-2-4-7(6)9-5-10-11-8/h1-5H,(H,9,10)(H,11,12)
InChIKey IBGDNKGFQNPQDK-UHFFFAOYSA-N
Molecular Weight 161.164 g/mol
SMILES N1C(c2ccccc2NC=N1)=O
SPLASH splash10-03e9-7900000000-da0639832b922f570801
Synonyms 1,4-Dihydro-5H-1,3,4-benzotriazepin-5-one 3,4-Dihydro-1,3,4-benzotriazepin-5-one
Wiley ID 1481537