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2-(tert-Butoxycarbonyl)-3,4,5,6,7,8-hexahydrocyclopent[c]azepin-1-(2H)-one
SpectraBase Compound ID 7xtFv79X330
InChI InChI=1S/C14H21NO3/c1-14(2,3)18-13(17)15-9-5-7-10-6-4-8-11(10)12(15)16/h4-9H2,1-3H3
InChIKey SHPZAPSWBRHTDP-UHFFFAOYSA-N
Mol Weight 251.33 g/mol
Molecular Formula C14H21NO3
Exact Mass 251.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2p0JzX3GrV
Name 2-(tert-Butoxycarbonyl)-3,4,5,6,7,8-hexahydrocyclopent[c]azepin-1-(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO3
InChI InChI=1S/C14H21NO3/c1-14(2,3)18-13(17)15-9-5-7-10-6-4-8-11(10)12(15)16/h4-9H2,1-3H3
InChIKey SHPZAPSWBRHTDP-UHFFFAOYSA-N
Molecular Weight 251.326 g/mol
SMILES C1(N(CCCC2=C1CCC2)C(OC(C)(C)C)=O)=O
SPLASH splash10-0002-4900000000-9aac4f99e3744649f209
Source of Spectrum J-56-2695-7
Synonyms tert-Butyl 1-oxo-3,4,5,6,7,8-hexahydrocyclopenta[c]azepine-2(1H)-carboxylate
Wiley ID 1254594