Debug Info

object
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_id
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5dfxqaIXXBv
spectrumID
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5dfxqaIXXBv
cost
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specType
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131072
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MS (GC)
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Mass Spectrum (GC)
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compound
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Pyrene
SpectraBase Compound ID JSV5py4Jyyt
InChI InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H
InChIKey BBEAQIROQSPTKN-UHFFFAOYSA-N
Mol Weight 202.26 g/mol
Molecular Formula C16H10
Exact Mass 202.07825 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5dfxqaIXXBv
Name PYRENE
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C16H10
InChI InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H
InChIKey BBEAQIROQSPTKN-UHFFFAOYSA-N
Molecular Weight 202.0780
SMILES c12cccc3c1c1c(cccc1cc3)cc2
SPLASH splash10-0udi-2590000000-4a64807864061cc968ae
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
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