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1,3-Benzoxazole, 6,7-difluoro-2-(hexahydro-1H-1,4-diazepin-1-yl)-
SpectraBase Compound ID BxQqitGrDZr
InChI InChI=1S/C12H13F2N3O/c13-8-2-3-9-11(10(8)14)18-12(16-9)17-6-1-4-15-5-7-17/h2-3,15H,1,4-7H2
InChIKey YBVNVPUZIXCWCJ-UHFFFAOYSA-N
Mol Weight 253.25 g/mol
Molecular Formula C12H13F2N3O
Exact Mass 253.102668 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzcpmlNT2T1
Name 1,3-Benzoxazole, 6,7-difluoro-2-(hexahydro-1H-1,4-diazepin-1-yl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13F2N3O
InChI InChI=1S/C12H13F2N3O/c13-8-2-3-9-11(10(8)14)18-12(16-9)17-6-1-4-15-5-7-17/h2-3,15H,1,4-7H2
InChIKey YBVNVPUZIXCWCJ-UHFFFAOYSA-N
Molecular Weight 253.253 g/mol
SMILES N1CCCN(CC1)c1nc2ccc(c(c2o1)F)F
SPLASH splash10-0006-9200000000-2c042f45b7e3a06c68dc
Source of Spectrum IY-2-4946-5
Synonyms 2-(1,4-diazepan-1-yl)-6,7-difluoro-1,3-benzoxazole
Wiley ID 1657448