Sample Description:

Molecular Formula: C10H15N Molecular Weight: 149.233 InChI= 1/C10H15N/c1-3-11(4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3 IUPAC Name:  N,N-Diethylaniline CAS Number: 91-66-7 PubChem: 7061 NMRShiftDB: 10015944 Spectrometer: Bruker ARX 400 MHz Solvent: CDCl3 Provided by:  WebSpectra: Intermediate (2) Problem #13

$> cat proton.ll
7.2234  .25
7.2179  .25
7.2126  .25
7.1799  .25
7.1957  .25
7.1899  .25
7.1829  .25
7.1777  .25

6.6764  .5
6.6563  .5
6.6394  .5
6.6373  .5
6.6214  .5
6.6192  .5

3.3262  1
3.3085  1
3.2909  1
3.2733  1

1.1445  1.5
1.1266  3
1.1091  1.5
			

$> cat carbon.ll
145.562
129.037
115.196
111.668
44.0822
12.3575
			

Automated VerifyIt Proton Assignments:

Automated VerifyIt Carbon Assignments:

Top 10 FindIt Molecular Structures Consistent With Molecular Formula and Proton Resonances:

The correct structure is at position 1.

 Best 10 structures in decreasing rating (structure ID shown in parentheses):
    1: 0.988240 (    7061)    2: 0.987360 (  210912)    3: 0.987206 (  108358)
    4: 0.986933 (  136373)    5: 0.985614 (  167154)    6: 0.983648 (  138221)
    7: 0.982257 ( 6429431)    8: 0.981135 (   50193)    9: 0.980229 (  115806)
   10: 0.980018 (  121771)
			

Top 10 FindIt Molecular Structures Consistent With Proton and Carbon Resonances:

The correct structure is at position 1.

 Best 10 structures in decreasing rating (structure ID shown in parentheses):
    1: 0.970445 (    7061)    2: 0.952382 ( 2758241)    3: 0.948575 (  118833)
    4: 0.934372 ( 3500272)    5: 0.932964 ( 1601139)    6: 0.930974 (  351227)
    7: 0.929923 (   21253)    8: 0.929659 ( 4227271)    9: 0.928271 ( 2307465)
   10: 0.923383 ( 4616900)
			

Comments:

The top FindIt structure is the correct one.