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Cyclohexanone, 4-methyl-, semicarbazone
SpectraBase Compound ID HxXD5SzqVI3
InChI InChI=1S/C8H15N3O/c1-6-2-4-7(5-3-6)10-11-8(9)12/h6H,2-5H2,1H3,(H3,9,11,12)/b10-7-
InChIKey HITUACBMYVLYDZ-YFHOEESVSA-N
Mol Weight 169.23 g/mol
Molecular Formula C8H15N3O
Exact Mass 169.121512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5713sayzbs
Name Cyclohexanone, 4-methyl-, semicarbazone
CAS Registry Number 5439-97-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H15N3O
InChI InChI=1S/C8H15N3O/c1-6-2-4-7(5-3-6)10-11-8(9)12/h6H,2-5H2,1H3,(H3,9,11,12)/b10-7-
InChIKey HITUACBMYVLYDZ-YFHOEESVSA-N
Molecular Weight 169.228 g/mol
SMILES NC(NN=C1CCC(C)CC1)=O
SPLASH splash10-0159-9300000000-a90ef8b8878a799a0402
Source of Spectrum W5-1989-46972-18564
Synonyms 4-Methylcyclohexanone semicarbazone
Wiley ID 1165734