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3,4-(Methylenedioxy)phenylacetonitrile
SpectraBase Compound ID VFpqXOub8G
InChI InChI=1S/C9H7NO2/c10-4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5H,3,6H2
InChIKey ZQPBOYASBNAXOZ-UHFFFAOYSA-N
Mol Weight 161.16 g/mol
Molecular Formula C9H7NO2
Exact Mass 161.047678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YslsWtKMdQ
Name 3,4-Methylenedioxybenzeneacetonitril
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7NO2
InChI InChI=1S/C9H7NO2/c10-4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5H,3,6H2
InChIKey ZQPBOYASBNAXOZ-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 161.160 g/mol
SMILES C(#N)Cc1ccc2c(c1)OCO2
SPLASH splash10-03di-0900000000-32c775ed5ac72da51678
Source of Spectrum SRH-2022-11445-0
Wiley ID 1833032