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BENZENEMETHANOL, 4-METHOXY-alpha-(2-NITROCYCLOPENTYL)-, [1alpha(R*),2alpha]-
SpectraBase Compound ID IsGkvPCmdQX
InChI InChI=1S/C13H17NO4/c1-18-10-7-5-9(6-8-10)13(15)11-3-2-4-12(11)14(16)17/h5-8,11-13,15H,2-4H2,1H3
InChIKey HPZFNJJPQYRTJO-UHFFFAOYSA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AI4IROSr1tC
Name BENZENEMETHANOL, 4-METHOXY-alpha-(2-NITROCYCLOPENTYL)-, [1alpha(R*),2alpha]-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-18-10-7-5-9(6-8-10)13(15)11-3-2-4-12(11)14(16)17/h5-8,11-13,15H,2-4H2,1H3
InChIKey HPZFNJJPQYRTJO-UHFFFAOYSA-N
Molecular Weight 251.1153
SMILES OC(C1C(N(=O)=O)CCC1)c1ccc(OC)cc1
SPLASH splash10-000i-3900000000-bf10b0eee69674300037
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany