Debug Info

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JG3HwGvPD5v
spectrumID
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JG3HwGvPD5v
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4-Methyl-5-(3,4-methylenedioxy)-phenylpyrimidine
SpectraBase Compound ID 2c2yAEXhOP3
InChI InChI=1S/C12H10N2O2/c1-8-10(5-13-6-14-8)9-2-3-11-12(4-9)16-7-15-11/h2-6H,7H2,1H3
InChIKey XYYMQUHSVBGSSO-UHFFFAOYSA-N
Mol Weight 214.22 g/mol
Molecular Formula C12H10N2O2
Exact Mass 214.074228 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JG3HwGvPD5v
Name 4-Methyl-5-(3,4-methylenedioxy)-phenylpyrimidine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N2O2
InChI InChI=1S/C12H10N2O2/c1-8-10(5-13-6-14-8)9-2-3-11-12(4-9)16-7-15-11/h2-6H,7H2,1H3
InChIKey XYYMQUHSVBGSSO-UHFFFAOYSA-N
Molecular Weight 214.224 g/mol
SMILES c1nc(c(cn1)-c1cc2c(cc1)OCO2)C
SPLASH splash10-03di-5590000000-62dcb5b55a979a876949
Source of Spectrum SWG-33-805-0
Synonyms 5-(benzo[d][1,3]dioxol-5-yl)-4-methylpyrimidine
Wiley ID 1808995
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