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4-Heptanone, semicarbazone
SpectraBase Compound ID 5qt0jpxAdJM
InChI InChI=1S/C8H17N3O/c1-3-5-7(6-4-2)10-11-8(9)12/h3-6H2,1-2H3,(H3,9,11,12)
InChIKey RXOSBDKCDBATQI-UHFFFAOYSA-N
Mol Weight 171.24 g/mol
Molecular Formula C8H17N3O
Exact Mass 171.137162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5HijUh2NH2W
Name 4-Heptanone, semicarbazone
Alternate Name(s) (1-Propylbutylideneamino)urea (heptan-4-ylideneamino)urea 1-(heptan-4-ylideneamino)urea
CAS Registry Number 3622-68-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H17N3O
InChI InChI=1S/C8H17N3O/c1-3-5-7(6-4-2)10-11-8(9)12/h3-6H2,1-2H3,(H3,9,11,12)
InChIKey RXOSBDKCDBATQI-UHFFFAOYSA-N
Molecular Weight 171.244 g/mol
SMILES N(N=C(CCC)CCC)C(=O)N
SPLASH splash10-006x-9300000000-fd5cab60e356f624cf69
Source of Spectrum DC-0-10-6
Wiley ID 15884