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2-Fluoro ADB
SpectraBase Compound ID BVVcY6Y51eJ
InChI InChI=1S/C20H28FN3O3/c1-6-9-13(21)12-24-15-11-8-7-10-14(15)16(23-24)18(25)22-17(19(26)27-5)20(2,3)4/h7-8,10-11,13,17H,6,9,12H2,1-5H3,(H,22,25)/t13?,17-/m1/s1
InChIKey WOONLIUQOOLXHP-LRHAYUFXSA-N
Mol Weight 377.46 g/mol
Molecular Formula C20H28FN3O3
Exact Mass 377.21147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8DD3DUP0ydI
Name 2-Fluoro ADB
Catalog Number 9002715
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28FN3O3
InChI InChI=1S/C20H28FN3O3/c1-6-9-13(21)12-24-15-11-8-7-10-14(15)16(23-24)18(25)22-17(19(26)27-5)20(2,3)4/h7-8,10-11,13,17H,6,9,12H2,1-5H3,(H,22,25)/t13?,17-/m1/s1
InChIKey WOONLIUQOOLXHP-LRHAYUFXSA-N
Molecular Weight 377.460 g/mol
SMILES C(F)(C[n]1nc(C(=O)N[C@@](C(C)(C)C)(C(OC)=O)[H])c2c1cccc2)CCC
SPLASH splash10-001i-2592000000-50882954e7cbc0b56d87
Source of Spectrum CAY-2023-1097-0
Wiley ID 1889053