Debug Info

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IbpXrfwXJ6Q
spectrumID
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IbpXrfwXJ6Q
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2-Chloranyl-4,7,7-trimethyl-bicyclo[2.2.1]heptan-3-one
SpectraBase Compound ID Hds3gIncnLC
InChI InChI=1S/C10H15ClO/c1-9(2)6-4-5-10(9,3)8(12)7(6)11/h6-7H,4-5H2,1-3H3/t6-,7?,10+/m0/s1
InChIKey TYKNIXUIZSBZSO-UHFFFAOYSA-N
Mol Weight 186.68 g/mol
Molecular Formula C10H15ClO
Exact Mass 186.081143 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbpXrfwXJ6Q
Name 2-Chloranyl-4,7,7-trimethyl-bicyclo[2.2.1]heptan-3-one
CAS Registry Number 1925-57-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15ClO
InChI InChI=1S/C10H15ClO/c1-9(2)6-4-5-10(9,3)8(12)7(6)11/h6-7H,4-5H2,1-3H3/t6-,7?,10+/m1/s1
InChIKey TYKNIXUIZSBZSO-UHFFFAOYSA-N
Molecular Weight 186.682 g/mol
SMILES [C@]12(C([C@](CC2)(C(C1=O)Cl)[H])(C)C)C
SPLASH splash10-053r-9500000000-77ce54a96778618f0f5b
Source of Spectrum O-32-336-0
Synonyms 2-Chloro-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanone 2-Chloro-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one 3-Chloro-1,7,7-trimethyl-norbornan-2-one 3-Chloro-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
Wiley ID 1182702
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