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(E)-4,4-dimethyl-1-(4-nitrophenyl)-1-penten-3-ol
SpectraBase Compound ID IxNvUuH00nb
InChI InChI=1S/C13H17NO3/c1-13(2,3)12(15)9-6-10-4-7-11(8-5-10)14(16)17/h4-9,12,15H,1-3H3/b9-6+
InChIKey UBYPYFBYVCHAAM-RMKNXTFCSA-N
Mol Weight 235.28 g/mol
Molecular Formula C13H17NO3
Exact Mass 235.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11yKpTGZiMw
Name (E)-4,4-dimethyl-1-(4-nitrophenyl)-1-penten-3-ol
Alternate Name(s) (E)-4,4-dimethyl-1-(4-nitrophenyl)pent-1-en-3-ol
CAS Registry Number 86983-97-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c1-13(2,3)12(15)9-6-10-4-7-11(8-5-10)14(16)17/h4-9,12,15H,1-3H3/b9-6+
InChIKey UBYPYFBYVCHAAM-RMKNXTFCSA-N
Molecular Weight 235.283 g/mol
SMILES OC(C(C)(C)C)\C=C\c1ccc(N(=O)=O)cc1
SPLASH splash10-0a6r-9300000000-86aae19911137b092450
Source of Spectrum B-36-539-0
Wiley ID 1237088