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Cumyl-INACA
SpectraBase Compound ID 4jWSw8G5RKk
InChI InChI=1S/C17H17N3O/c1-17(2,12-8-4-3-5-9-12)18-16(21)15-13-10-6-7-11-14(13)19-20-15/h3-11H,1-2H3,(H,18,21)(H,19,20)
InChIKey COOPWWXIRLDJCP-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C17H17N3O
Exact Mass 279.137162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DSF3HoCANCH
Name CUMYL-INACA
Catalog Number 37055
Lot Number 654246
CAS Registry Number 1631075-21-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 279.137162178 u
Formula C17H17N3O
InChI InChI=1S/C17H17N3O/c1-17(2,12-8-4-3-5-9-12)18-16(21)15-13-10-6-7-11-14(13)19-20-15/h3-11H,1-2H3,(H,18,21)(H,19,20)
InChIKey COOPWWXIRLDJCP-UHFFFAOYSA-N
Molecular Weight 279.343 g/mol
Purity >=98%
Quality 987
SMILES N(C(C1=NNC2=C1C=CC=C2)=O)C(C)(C)C1=CC=CC=C1
SPLASH splash10-02mj-3920000000-d0148296e5d2f32936e9
Source of Spectrum CAY-2024-2271-0
Synonyms N-(2-phenylpropan-2-yl)-1H-indazole-3-carboxamide
Wiley ID 1890456