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Bicyclo[2.2.1]heptan-2-one, 3-hydroxy-4,7,7-trimethyl-3-(1-methylethyl)-
SpectraBase Compound ID IcMeBiGhuWr
InChI InChI=1S/C13H22O2/c1-8(2)13(15)10(14)9-6-7-12(13,5)11(9,3)4/h8-9,15H,6-7H2,1-5H3/t9-,12-,13+/m1/s1
InChIKey ZDZIFMPCBGAHQR-WQAKAFBOSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HuFqrS9qG94
Name Bicyclo[2.2.1]heptan-2-one, 3-hydroxy-4,7,7-trimethyl-3-(1-methylethyl)-
CAS Registry Number 69745-82-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-8(2)13(15)10(14)9-6-7-12(13,5)11(9,3)4/h8-9,15H,6-7H2,1-5H3/t9-,12-,13+/m1/s1
InChIKey ZDZIFMPCBGAHQR-WQAKAFBOSA-N
Molecular Weight 210.317 g/mol
SMILES O[C@@]1([C@@]2(C)C(C)(C)[C@@](C1=O)(CC2)[H])C(C)C
SPLASH splash10-03dl-9400000000-7c550cedf3fc55528e02
Source of Spectrum W5-16922-0-0
Synonyms 3-Hydroxy-3-isopropyl-4,7,7-trimethylbicyclo[2.2.1]heptan-2-one 3-Hydroxy-3-isopropyl-4,7,7-trimethyl-norbornan-2-one 3-Hydroxy-4,7,7-trimethyl-3-propan-2-yl-2-bicyclo[2.2.1]heptanone 3-Hydroxy-4,7,7-trimethyl-3-propan-2-ylbicyclo[2.2.1]heptan-2-one 4,7,7-trimethyl-3-oxidanyl-3-propan-2-yl-bicyclo[2.2.1]heptan-2-one
Wiley ID 1209565