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1-Penten-3-ol, 4-methyl-1-(4-nitrophenyl)-, (E)-
SpectraBase Compound ID J37ep3Da8ou
InChI InChI=1S/C12H15NO3/c1-9(2)12(14)8-5-10-3-6-11(7-4-10)13(15)16/h3-9,12,14H,1-2H3/b8-5+
InChIKey VDTZZAILTDLVBZ-VMPITWQZSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqwhHEPHATI
Name 1-Penten-3-ol, 4-methyl-1-(4-nitrophenyl)-, (E)-
CAS Registry Number 86983-93-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-9(2)12(14)8-5-10-3-6-11(7-4-10)13(15)16/h3-9,12,14H,1-2H3/b8-5+
InChIKey VDTZZAILTDLVBZ-VMPITWQZSA-N
Molecular Weight 221.256 g/mol
SMILES OC(\C=C\c1ccc(N(=O)=O)cc1)C(C)C
SPLASH splash10-004i-2900000000-6ab0acd0459f9d391967
Source of Spectrum B-36-538-0
Synonyms (1E)-4-methyl-1-(4-nitrophenyl)-1-penten-3-ol (E)-4-Methyl-1-p-nitrophenylpent-1-en-3-ol
Wiley ID 1221231