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m-Cresol, 6-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-, acetate, (1S,2R)-(-)-
SpectraBase Compound ID H920MCxtbzQ
InChI InChI=1S/C17H22O2/c1-11-5-6-14(15(9-11)19-12(2)18)16(3)8-7-13-10-17(13,16)4/h5-6,9,13H,7-8,10H2,1-4H3/t13?,16-,17-/m0/s1
InChIKey WONQLSBVWXXLGQ-LMARGRMVSA-N
Mol Weight 258.36 g/mol
Molecular Formula C17H22O2
Exact Mass 258.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZF4NzlAYBx
Name m-Cresol, 6-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-, acetate, (1S,2R)-(-)-
Alternate Name(s) Phenol, 2-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-5-methyl-, acetate, (1.alpha.,2.alpha.,5.alpha.)-(.+-.)- 2-(1,2-Dimethylbicyclo[3.1.0]hex-2-yl)-5-methylphenyl acetate 2-[(1S,2R)-1,2-dimethylbicyclo[3.1.0]hex-2-yl]-5-methylphenyl acetate (+/-)-Debromoepilaurinterol acetate (.+-.)-Debromoepilaurinterol acetate Debromolaurinterol acetate (.+/-.)-Debromoepilaurinterol acetate Debromo-epilaurinterol acetate Phenol, 2-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-5-methyl-, acetate, (1.alpha.,2.alpha.,5.alpha.)-(.+/-.)- Phenol, 2-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-5-methyl-, acetate, (1alpha,2alpha,5alpha)-(+/-)- Phenol, 2-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-5-methyl-, acetate, (1alpha,2alpha,5alpha)-(.+/-.)-
CAS Registry Number 13002-87-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O2
InChI InChI=1S/C17H22O2/c1-11-5-6-14(15(9-11)19-12(2)18)16(3)8-7-13-10-17(13,16)4/h5-6,9,13H,7-8,10H2,1-4H3/t13?,16-,17-/m0/s1
InChIKey WONQLSBVWXXLGQ-LMARGRMVSA-N
Molecular Weight 258.361 g/mol
SMILES [C@]12([C@](c3c(OC(=O)C)cc(cc3)C)(CCC1C2)C)C
SPLASH splash10-066s-0930000000-32596411be04a380fd41
Source of Spectrum B-26-355-21
Wiley ID 1262168