Debug Info

object
{15}
_id
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JCrdeE6RrZD
spectrumID
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JCrdeE6RrZD
cost
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specType
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131072
xnmrNucleus
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dbLocation
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WMS3X:124555:1
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properties
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analyticalTechnique
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MS (GC)
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Mass Spectrum (GC)
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compound
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Menthenyl ketone
SpectraBase Compound ID 2QIHOuXgeiD
InChI InChI=1S/C13H22O/c1-5-13(14)12-8-11(9(2)3)7-6-10(12)4/h6,9,11-12H,5,7-8H2,1-4H3
InChIKey DZSVIVLGBJKQAP-UHFFFAOYSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JCrdeE6RrZD
Name 1-Propanone, 1-p-menth-6-en-2-yl-
CAS Registry Number 31375-17-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O
InChI InChI=1S/C13H22O/c1-5-13(14)12-8-11(9(2)3)7-6-10(12)4/h6,9,11-12H,5,7-8H2,1-4H3
InChIKey DZSVIVLGBJKQAP-UHFFFAOYSA-N
Molecular Weight 194.318 g/mol
SMILES CCC(=O)C1CC(C(C)C)CC=C1C
SPLASH splash10-0563-9100000000-fb0d4e4057bffd911a56
Source of Spectrum XW-331-0-0
Synonyms 1-Propanone, 1-[2-methyl-5-(1-methylethyl)-2-cyclohexen-1-yl]- 1-(5-Isopropyl-2-methyl-2-cyclohexen-1-yl)-1-propanone 1-(2-Methyl-5-propan-2-yl-1-cyclohex-2-enyl)-1-propanone 1-(2-Methyl-5-propan-2-yl-cyclohex-2-en-1-yl)propan-1-one 1-(5-isopropyl-2-methyl-cyclohex-2-en-1-yl)propan-1-one 1-(p-menth-1-en-6-yl)propan-1-one 1-(p-menthen-6(2)-yl)-1-propanone 1-(p-Menthen-6-yl)-1-propanone 1-1-p-Menthen-6-yl-1-propanone 2-Propionyl-6-menthene Menthenyl ketone Nerone AI3-36186 BRN 2327817 EINECS 250-600-3 NSC 22295
Wiley ID 1191351
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