Debug Info

object
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_id
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J9mTMMJBpXh
spectrumID
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J9mTMMJBpXh
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Mass Spectrum (GC)
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Heptadecanoic acid, 16-methyl-, methyl ester
SpectraBase Compound ID KUN4wqLJixw
InChI InChI=1S/C19H38O2/c1-18(2)16-14-12-10-8-6-4-5-7-9-11-13-15-17-19(20)21-3/h18H,4-17H2,1-3H3
InChIKey KDQIFKKWPMBNOH-UHFFFAOYSA-N
Mol Weight 298.5 g/mol
Molecular Formula C19H38O2
Exact Mass 298.28718 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J9mTMMJBpXh
Name 16-Methylheptadecanoic acid methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H38O2
InChI InChI=1S/C19H38O2/c1-18(2)16-14-12-10-8-6-4-5-7-9-11-13-15-17-19(20)21-3/h18H,4-17H2,1-3H3
InChIKey KDQIFKKWPMBNOH-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 298.511 g/mol
SMILES COC(=O)CCCCCCCCCCCCCCC(C)C
SPLASH splash10-00dr-9200000000-ac3ea8ac74eb90c60ef8
Source of Spectrum SRH-2022-2180-0
Wiley ID 1824543
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