Chem
J-GLOBAL ID:200907059804864690
Nikkaji number:J1.514.071B
(3S)-3-Methyl-5-isopropyl-6-oxo-3,6-dihydro-2H-1,4-oxazine-3α-carbonitrile
(3S)-3-メチル-5-イソプロピル-6-オキソ-3,6-ジヒドロ-2H-1,4-オキサジン-3α-カルボニトリル
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C9 H12 N2 O2
Molecular formula furigana:
C9-H12-N2-O2
Molecular weight:
180.207
InChI:
InChI=1S/C9H12N2O2/c1-6(2)7-8(12)13-5-9(3,4-10)11-7/h6H,5H2,1-3H3/t9-/m0/s1
InChI key:
KNSPSWLHHSHZFV-VIFPVBQESA-N
SMILES:
CC(C)C1=N[C@](C)(COC1=O)C#N
Systematic name (3):
(3S)-3-メチル-5-イソプロピル-6-オキソ-3,6-ジヒドロ-2H-1,4-オキサジン-3α-カルボニトリル
(3S)-3-メチル-6-オキソ-5-(プロパン-2-イル)-3,6-ジヒドロ-2H-オキサジン-3-カルボニトリル
(3S)-3-methyl-6-oxo-5-(propan-2-yl)-3,6-dihydro-2H-oxazine-3-carbonitrile
Other name (1):
(3S)-3-Methyl-5-isopropyl-6-oxo-3,6-dihydro-2H-1,4-oxazine-3α-carbonitrile
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