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2-Amino-4-isopropyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
SpectraBase Compound ID 7EJFv5KZCbx
InChI InChI=1S/C13H16N2O2/c1-7(2)11-8(6-14)13(15)17-10-5-3-4-9(16)12(10)11/h7,11H,3-5,15H2,1-2H3
InChIKey YOMQUOVFBREBBW-UHFFFAOYSA-N
Mol Weight 232.28 g/mol
Molecular Formula C13H16N2O2
Exact Mass 232.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6bO5bLAvV8u
Name 2-Amino-4-isopropyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
CAS Registry Number 302785-66-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O2
InChI InChI=1S/C13H16N2O2/c1-7(2)11-8(6-14)13(15)17-10-5-3-4-9(16)12(10)11/h7,11H,3-5,15H2,1-2H3
InChIKey YOMQUOVFBREBBW-UHFFFAOYSA-N
Molecular Weight 232.283 g/mol
SMILES NC1=C(C(C2=C(CCCC2=O)O1)C(C)C)C#N
SPLASH splash10-000i-3900000000-5ed7b0aa7187f27cf2a7
Synonyms 2-Amino-4-isopropyl-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile 2-Amino-4-isopropyl-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile 2-Amino-5-oxo-4-propan-2-yl-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile 2-Amino-5-oxo-4-propan-2-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile 2-Azanyl-5-oxidanylidene-4-propan-2-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile
Wiley ID 1460992