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(2Z)-2-cyano-2-(4-isopropyl-5-keto-imidazolidin-2-ylidene)acetic acid methyl ester
SpectraBase Compound ID FsQi60iSqSO
InChI InChI=1S/C10H13N3O3/c1-5(2)7-9(14)13-8(12-7)6(4-11)10(15)16-3/h5,7,12H,1-3H3,(H,13,14)/b8-6-
InChIKey ZPJVSBOFHQWFEP-VURMDHGXSA-N
Mol Weight 223.23 g/mol
Molecular Formula C10H13N3O3
Exact Mass 223.095691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vljilHt1WQ
Name (2Z)-2-cyano-2-(4-isopropyl-5-keto-imidazolidin-2-ylidene)acetic acid methyl ester
Alternate Name(s) (2Z)-2-cyano-2-(4-oxo-5-propan-2-yl-2-imidazolidinylidene)acetic acid methyl ester Methyl (2Z)-2-cyano-2-(4-isopropyl-5-oxo-imidazolidin-2-ylidene)acetate Methyl (2Z)-2-cyano-2-(4-oxidanylidene-5-propan-2-yl-imidazolidin-2-ylidene)ethanoate Methyl (2Z)-2-cyano-2-(4-oxo-5-propan-2-ylimidazolidin-2-ylidene)acetate
CAS Registry Number 127855-61-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13N3O3
InChI InChI=1S/C10H13N3O3/c1-5(2)7-9(14)13-8(12-7)6(4-11)10(15)16-3/h5,7,12H,1-3H3,(H,13,14)/b8-6-
InChIKey ZPJVSBOFHQWFEP-VURMDHGXSA-N
Molecular Weight 223.232 g/mol
SMILES N1C(C(N\C1=C/(C(=O)OC)C#N)C(C)C)=O
SPLASH splash10-007k-0930000000-e77d9d50e45425bf3b28
Source of Spectrum K-123-2205-5
Wiley ID 1223801