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3-Amino-2-butyl-4-ethyl-4-phenyl-1-cyclobut-2-enone
SpectraBase Compound ID 72Pg6tPLMpE
InChI InChI=1S/C16H21NO/c1-3-5-11-13-14(17)16(4-2,15(13)18)12-9-7-6-8-10-12/h6-10H,3-5,11,17H2,1-2H3
InChIKey BMYZXCCBAFGVCQ-UHFFFAOYSA-N
Mol Weight 243.35 g/mol
Molecular Formula C16H21NO
Exact Mass 243.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3v4IJr3fKi
Name 3-Amino-2-butyl-4-ethyl-4-phenyl-1-cyclobut-2-enone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO
InChI InChI=1S/C16H21NO/c1-3-5-11-13-14(17)16(4-2,15(13)18)12-9-7-6-8-10-12/h6-10H,3-5,11,17H2,1-2H3
InChIKey BMYZXCCBAFGVCQ-UHFFFAOYSA-N
Molecular Weight 243.350 g/mol
SMILES NC=1C(c2ccccc2)(CC)C(C1CCCC)=O
SPLASH splash10-056u-6970000000-d41e00dbef77f915436e
Source of Spectrum K-127-1292-9
Synonyms 3-Amino-2-butyl-4-ethyl-4-phenyl-cyclobut-2-en-1-one 3-Azanyl-2-butyl-4-ethyl-4-phenyl-cyclobut-2-en-1-one
Wiley ID 1246275