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2-Isopropyl-1-(4-nitrophenyl)but-3-en-1-ol

View entire compound with spectra: 2 MS (GC)

2-Isopropyl-1-(4-nitrophenyl)but-3-en-1-ol
SpectraBase Compound ID 4DJ4FOMakCT
InChI InChI=1S/C13H17NO3/c1-4-12(9(2)3)13(15)10-5-7-11(8-6-10)14(16)17/h4-9,12-13,15H,1H2,2-3H3
InChIKey DHWXGHQYWXAUHY-UHFFFAOYSA-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 LXGBfuym1mw
Name 2-ISOPROPYL-1-(4-NITROPHENYL)BUT-3-EN-1-OL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c1-4-12(9(2)3)13(15)10-5-7-11(8-6-10)14(16)17/h4-9,12-13,15H,1H2,2-3H3
InChIKey DHWXGHQYWXAUHY-UHFFFAOYSA-N
Molecular Weight 235.1204
SMILES OC(C(C=C)C(C)C)c1ccc(cc1)N(=O)=O
SPLASH splash10-0kur-9300000000-cc183bcb83ea5b28c656
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany