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6-Nitropiperonyl alcohol
SpectraBase Compound ID LcKZ3febf47
InChI InChI=1S/C8H7NO5/c10-3-5-1-7-8(14-4-13-7)2-6(5)9(11)12/h1-2,10H,3-4H2
InChIKey XSKQKDTZQNFCCB-UHFFFAOYSA-N
Mol Weight 197.15 g/mol
Molecular Formula C8H7NO5
Exact Mass 197.032422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dne9O8pgHxI
Name (6-Nitro-2H-1,3-benzodioxol-5-yl)methanol
CAS Registry Number 15341-08-9
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 197.032422324 u
Formula C8H7NO5
InChI InChI=1S/C8H7NO5/c10-3-5-1-7-8(14-4-13-7)2-6(5)9(11)12/h1-2,10H,3-4H2
InChIKey XSKQKDTZQNFCCB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 197.146 g/mol
Nominal Mass 197 u
Quality 997
Retention Index 1798
SMILES OCC1=C(C=C2C(=C1)OCO2)[N+](=O)[O-]
SPLASH splash10-006t-9700000000-68c4d887d9f3a89d217b
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (6-Nitrobenzo[d][1,3]dioxol-5-yl)methanol
Technique GC/MS
Wiley ID DD2024_024263