1-(2-Adamantyl)-4-[3-(4-bromo-1H-pyrazol-1-yl)propanoyl]piperazine

SpectraBase Compound ID	IG4FvlNijyR
InChI	InChI=1S/C20H29BrN4O/c21-18-12-22-25(13-18)2-1-19(26)23-3-5-24(6-4-23)20-16-8-14-7-15(10-16)11-17(20)9-14/h12-17,20H,1-11H2/t14-,15+,16-,17+,20?
InChIKey	BHKXOTZPMMDKLZ-YMSSVPQNSA-N Google Search
Mol Weight	421.38 g/mol
Molecular Formula	C20H29BrN4O
Exact Mass	420.152475 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	IL80Q2ViWeZ
Name	1-(2-Adamantyl)-4-[3-(4-bromo-1H-pyrazol-1-yl)propanoyl]piperazine
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H29BrN4O
InChI	InChI=1S/C20H29BrN4O/c21-18-12-22-25(13-18)2-1-19(26)23-3-5-24(6-4-23)20-16-8-14-7-15(10-16)11-17(20)9-14/h12-17,20H,1-11H2/t14-,15+,16-,17+,20?
InChIKey	BHKXOTZPMMDKLZ-YMSSVPQNSA-N
Molecular Weight	421.383 g/mol
SMILES	C(CC(N1CCN(CC1)C1[C@]2(C[C@@]3(C[C@](C2)(C[C@]1(C3)[H])[H])[H])[H])=O)[n]1cc(cn1)Br
SPLASH	splash10-004l-7910000000-c6951f9db19021b932b1
Synonyms	1-[4-(2-adamantyl)-1-piperazinyl]-3-(4-bromo-1-pyrazolyl)-1-propanone 1-[4-(2-adamantyl)piperazin-1-yl]-3-(4-bromanylpyrazol-1-yl)propan-1-one 1-[4-(2-adamantyl)piperazin-1-yl]-3-(4-bromopyrazol-1-yl)propan-1-one 1-[4-(2-adamantyl)piperazino]-3-(4-bromopyrazol-1-yl)propan-1-one
Wiley ID	1452056