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3-Buten-2-one, 4-(o-methoxyphenyl)-, semicarbazone
SpectraBase Compound ID GDnQ5ndKp42
InChI InChI=1S/C12H15N3O2/c1-9(14-15-12(13)16)7-8-10-5-3-4-6-11(10)17-2/h3-8H,1-2H3,(H3,13,15,16)/b8-7+,14-9+
InChIKey KTHNAJCHORXLFV-HTEJKWGNSA-N
Mol Weight 233.27 g/mol
Molecular Formula C12H15N3O2
Exact Mass 233.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hLkfVbbCB5
Name 3-Buten-2-one, 4-(o-methoxyphenyl)-, semicarbazone
Alternate Name(s) (2E,3E)-4-(2-methoxyphenyl)-3-buten-2-one semicarbazone 2-Methoxybenzylideneacetone semicarbazone
CAS Registry Number 17014-26-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15N3O2
InChI InChI=1S/C12H15N3O2/c1-9(14-15-12(13)16)7-8-10-5-3-4-6-11(10)17-2/h3-8H,1-2H3,(H3,13,15,16)/b8-7+,14-9+
InChIKey KTHNAJCHORXLFV-HTEJKWGNSA-N
Molecular Weight 233.271 g/mol
SMILES N(\N=C\(\C=C\c1c(OC)cccc1)C)C(=O)N
SPLASH splash10-001r-6920000000-85c2ba2637c14af7b06d
Source of Spectrum T-67-2397-0
Wiley ID 31456