Debug Info

object
{15}
_id
:
8Uih6A6V1Pu
spectrumID
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8Uih6A6V1Pu
cost
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1
specType
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131072
xnmrNucleus
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dbLocation
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WMS3X:151728:1
hasStructureAssignments
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properties
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analyticalTechnique
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MS (GC)
analyticalTechniqueLongName
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Mass Spectrum (GC)
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false
spectralOutlier
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compound
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lastUpdated
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1735074081058
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false

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Phenol, 3-octyl-
SpectraBase Compound ID IKF2NgbLDEB
InChI InChI=1S/C14H22O/c1-2-3-4-5-6-7-9-13-10-8-11-14(15)12-13/h8,10-12,15H,2-7,9H2,1H3
InChIKey QEVPNCHYTKOQMP-UHFFFAOYSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Uih6A6V1Pu
Name Phenol, 3-octyl-
CAS Registry Number 20056-69-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-2-3-4-5-6-7-9-13-10-8-11-14(15)12-13/h8,10-12,15H,2-7,9H2,1H3
InChIKey QEVPNCHYTKOQMP-UHFFFAOYSA-N
Molecular Weight 206.329 g/mol
SMILES Oc1cc(ccc1)CCCCCCCC
SPLASH splash10-0a4i-5910000000-b6fad80efbfcbc666905
Source of Spectrum O-2-2792-0
Synonyms 3-Octylphenol Phenol, m-octyl- 3-Octyl-phenol M-N-octylphenol meta-n-octyl-phenol
Wiley ID 1204945
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