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N-[4-(difluoromethoxy)phenyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine
SpectraBase Compound ID 79Ctuic5y8W
InChI InChI=1S/C13H16F2N2O/c14-13(15)18-11-7-5-10(6-8-11)17-12-4-2-1-3-9-16-12/h5-8,13H,1-4,9H2,(H,16,17)
InChIKey YGIFOAFUINSKEN-UHFFFAOYSA-N
Mol Weight 254.28 g/mol
Molecular Formula C13H16F2N2O
Exact Mass 254.123069 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0dUNp6pBFA
Name N-[4-(difluoromethoxy)phenyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16F2N2O
InChI InChI=1S/C13H16F2N2O/c14-13(15)18-11-7-5-10(6-8-11)17-12-4-2-1-3-9-16-12/h5-8,13H,1-4,9H2,(H,16,17)
InChIKey YGIFOAFUINSKEN-UHFFFAOYSA-N
Molecular Weight 254.281 g/mol
SMILES N(C1=NCCCCC1)c1ccc(OC(F)F)cc1
SPLASH splash10-0udj-9340000000-b59b2474143f6faf17b0
Source of Spectrum IY-1-4266-3
Synonyms N-[4-[bis(fluoranyl)methoxy]phenyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine
Wiley ID 1650659