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3-(4-chlorophenyl)-1-(1.lambda.6,2.lambda.6,3.lambda.6,4.lambda.6,5.lambda.6,6.lambda.6,7.lambda.6,8.lambda.6,9.lambda.6,10.lambda.6,11.lambda.6,12.lambda.6-dodecaboranonadecacyclo[5.5.0.01,3.01,4.02,10.02,11.02,12.03,5.03,10.04,6.04,7.05,9.05,10.06,8.06,9.07,12.08,11.08,12.09,11]dodecan-1-yl)prop-2-en-1-ol
SpectraBase Compound ID BdaLqxOVNBb
InChI InChI=1S/C9H19B12ClO/c22-8-4-1-7(2-5-8)3-6-9(23)21-16-11-10-12(11,16)14(10)15(10)13(10,11)17(11,16,21)19(13,15,21)20(14,15,21)18(12,14,16)21/h1-6,9-20,23H
InChIKey BUQCARDBWKWLLE-UHFFFAOYSA-N
Mol Weight 308 g/mol
Molecular Formula C9H19B12ClO
Exact Mass 310.224105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID qRTx7ziwaE
Name 3-(4-chlorophenyl)-1-(1.lambda.6,2.lambda.6,3.lambda.6,4.lambda.6,5.lambda.6,6.lambda.6,7.lambda.6,8.lambda.6,9.lambda.6,10.lambda.6,11.lambda.6,12.lambda.6-dodecaboranonadecacyclo[5.5.0.01,3.01,4.02,10.02,11.02,12.03,5.03,10.04,6.04,7.05,9.05,10.06,8.06,9.07,12.08,11.08,12.09,11]dodecan-1-yl)prop-2-en-1-ol
Appearance Yellow amorphous solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.224104971 u
Formula C9H19B12ClO
InChI InChI=1S/C9H19B12ClO/c22-8-4-1-7(2-5-8)3-6-9(23)21-16-11-10-12(11,16)14(10)15(10)13(10,11)17(11,16,21)19(13,15,21)20(14,15,21)18(12,14,16)21/h1-6,9-20,23H
InChIKey BUQCARDBWKWLLE-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202201275
Molecular Weight 308.423 g/mol
Quality 27
SMILES OC([B]1234[BH]567[BH]448[BH]119[BH]22%10[BH]353[BH]656[BH]787[BH]668[BH]92([BH]4178)[BH]%10356)C=CC1=CC=C(C=C1)Cl
SPLASH splash10-00or-0900000000-6e0b6653a686b2e4b48c
Source of Spectrum K1-26-SM6-1c (DOI: 10.1002/ejoc.202201275)
Wiley ID 1910481