Debug Info

object
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_id
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Il9Ur4w4REc
spectrumID
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Il9Ur4w4REc
cost
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specType
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131072
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WMS3X:260267:1
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MS (GC)
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Mass Spectrum (GC)
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Allyl 2-benzylbenzoate
SpectraBase Compound ID 7fd5mFVsuKb
InChI InChI=1S/C17H16O2/c1-2-12-19-17(18)16-11-7-6-10-15(16)13-14-8-4-3-5-9-14/h2-11H,1,12-13H2
InChIKey OPOMFTNQIQOXHH-UHFFFAOYSA-N
Mol Weight 252.31 g/mol
Molecular Formula C17H16O2
Exact Mass 252.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Il9Ur4w4REc
Name Allyl 2-benzylbenzoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O2
InChI InChI=1S/C17H16O2/c1-2-12-19-17(18)16-11-7-6-10-15(16)13-14-8-4-3-5-9-14/h2-11H,1,12-13H2
InChIKey OPOMFTNQIQOXHH-UHFFFAOYSA-N
Molecular Weight 252.313 g/mol
SMILES C(c1c(Cc2ccccc2)cccc1)(=O)OCC=C
SPLASH splash10-03yl-0950000000-61cef685c1ddf59fd83f
Source of Spectrum F-48-7757-0
Synonyms 2-(Phenylmethyl)benzoic acid prop-2-enyl ester Prop-2-enyl 2-benzylbenzoate Prop-2-enyl 2-(phenylmethyl)benzoate
Wiley ID 1256294