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a-Methyl-6-nitropiperonyl alcohol
SpectraBase Compound ID Fjcjq9wb3hM
InChI InChI=1S/C9H9NO5/c1-5(11)6-2-8-9(15-4-14-8)3-7(6)10(12)13/h2-3,5,11H,4H2,1H3
InChIKey UHJMDARCOIYCHL-UHFFFAOYSA-N
Mol Weight 211.17 g/mol
Molecular Formula C9H9NO5
Exact Mass 211.048072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CbMG18MkDaL
Name 1-(6-nitro-1,3-benzodioxol-5-yl)ethanol
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO5
InChI InChI=1S/C9H9NO5/c1-5(11)6-2-8-9(15-4-14-8)3-7(6)10(12)13/h2-3,5,11H,4H2,1H3
InChIKey UHJMDARCOIYCHL-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI positive ion
Literature Reference DOI 10.1002/cbic.202200115
Molecular Weight 211.173 g/mol
SMILES OC(c1c(cc2OCOc2c1)[N+]([O-])=O)C
SPLASH splash10-01vt-1900000000-cd07d6e5b2343c1fdcb6
Source of Spectrum CBC-23-SM2-4
Wiley ID 1871723