For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(4R,5R,E)-2, 4-Dimethyl-5-(4-nitrophenyl)pent-2-ene-1,5-diol
SpectraBase Compound ID 4mDHHc92a0b
InChI InChI=1S/C13H17NO4/c1-9(8-15)7-10(2)13(16)11-3-5-12(6-4-11)14(17)18/h3-7,10,13,15-16H,8H2,1-2H3/b9-7+/t10-,13-/m1/s1
InChIKey HQZWAMPVBLQGLU-JTVYLNILSA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GkmTa9ZpkrY
Name (4R,5R,E)-2, 4-Dimethyl-5-(4-nitrophenyl)pent-2-ene-1,5-diol
Alternate Name(s) (4R,5R,E)-2,4-dimethyl-5-(4-nitrophenyl)pent-2-ene-1,5-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-9(8-15)7-10(2)13(16)11-3-5-12(6-4-11)14(17)18/h3-7,10,13,15-16H,8H2,1-2H3/b9-7+/t10-,13-/m1/s1
InChIKey HQZWAMPVBLQGLU-JTVYLNILSA-N
Literature Reference DOI 10.1002/adsc.200606106
Molecular Weight 251.282 g/mol
SMILES O[C@]([C@@](\C=C\(CO)C)(C)[H])(c1ccc(cc1)[N+](=O)[O-])[H]
SPLASH splash10-0uec-4900000000-60ee6018555ebc9bbaba
Source of Spectrum ASC-348-1231-9
Wiley ID 1764938