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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 Dd132LiUq
Name 2-Isopropyl-1-(4-nitrophenyl)but-3-en-1-ol
Alternate Name(s) 1-(4-nitrophenyl)-2-propan-2-yl-3-buten-1-ol 1-(4-nitrophenyl)-2-propan-2-yl-but-3-en-1-ol 2-Isopropyl-1-(4-nitrophenyl)-3-buten-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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 235.283 g/mol
SMILES OC(c1ccc(N(=O)=O)cc1)C(C(C)C)C=C
SPLASH splash10-0kur-9300000000-cc183bcb83ea5b28c656
Wiley ID 1482440