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1H-Indole-3-propanenitrile, 2-(1,1-dimethyl-2-propenyl)-.alpha.-(hydroxyimino)-
SpectraBase Compound ID KlB7lU9tiBf
InChI InChI=1S/C16H17N3O/c1-4-16(2,3)15-13(9-11(10-17)19-20)12-7-5-6-8-14(12)18-15/h4-8,18,20H,1,9H2,2-3H3/b19-11-
InChIKey JPQUMVKIXLERGZ-ODLFYWEKSA-N
Mol Weight 267.33 g/mol
Molecular Formula C16H17N3O
Exact Mass 267.137162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D8Anfy5gS0a
Name 1H-Indole-3-propanenitrile, 2-(1,1-dimethyl-2-propenyl)-.alpha.-(hydroxyimino)-
CAS Registry Number 114519-46-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N3O
InChI InChI=1S/C16H17N3O/c1-4-16(2,3)15-13(9-11(10-17)19-20)12-7-5-6-8-14(12)18-15/h4-8,18,20H,1,9H2,2-3H3/b19-11-
InChIKey JPQUMVKIXLERGZ-ODLFYWEKSA-N
Molecular Weight 267.332 g/mol
SMILES [nH]1c2ccccc2c(C\C(=N\O)C#N)c1C(C=C)(C)C
SPLASH splash10-014i-0190000000-9df93d95f30ab5cc9803
Source of Spectrum KC-1987-2477-25
Synonyms (2Z)-3-[2-(1,1-dimethyl-2-propenyl)-1H-indol-3-yl]-2-(hydroxyimino)propanenitrile 2-(1',1'-Dimethyl2'-propenyl)-3-(2'-cyano-2'-hydroxyimino-ethyl)-1H-indole
Wiley ID 1271271