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Product Name2-Methyl-5-phenylbenzoxazole
CAS61931-68-8
Molecular FormulaC14H11NO
Molecular Weight209.24
InChIInChI=1S/C14H11NO/c1-10-15-13-9-12(7-8-14(13)16-10)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey CHZDPBVCBBQQRP-UHFFFAOYSA-N
SmilesO1C2=CC=C(C3=CC=CC=C3)C=C2N=C1C
1HNMR
13CNMR
IR
Raman
400 MHz in CDCl3
Assign. Shift(ppm) A 7.841 B 7.597 C 7.50 D 7.443 E 7.349 F 2.643
Hz ppm Int.
3135.13 7.845 115 3133.79 7.842 174 3132.69 7.839 120 3041.87 7.612 127 3040.41 7.608 159 3038.57 7.604 53 3034.42 7.593 96 3033.45 7.591 174 3032.35 7.588 171 3030.27 7.583 34 3007.57 7.526 33 2999.02 7.505 232 2997.31 7.500 352 2982.42 7.463 103 2980.71 7.459 45 2975.10 7.445 199 2973.75 7.441 98 2968.87 7.429 57 2967.29 7.425 115 2965.33 7.420 30 2944.34 7.368 46 2943.12 7.365 81 2941.77 7.361 48 2937.62 7.351 37 2935.67 7.346 97 2933.72 7.341 31 2928.34 7.328 40 1056.27 2.643 1000
in CDCl3
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