Camphor_b
NMRanalyst Sample Application
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Sample Description:

 Molecular Formula: C10H16O
Molecular Weight: 152.233
InChI= 1/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3
IUPAC Name:  1,7,7-Trimethylnorboran-2-one
CAS Number: 464-48-2
PubChem: 2537
NMRShiftDB: 10008814
Spectrometer: 300 MHz
Solvent: CDCl3
Provided by:  FTNMR FID Archive - Pacific Lutheran University

*.fidnpntswrfp-rflnisw1rfp1-rfl1time
proton819286024.11-1664.862?
carbon819212820000.00-2107.480?


1D Proton Spectrum:

1D Proton Spectrum


1D Carbon Spectrum (Deuterated Solvent Resonances Subtracted):

1D Carbon Spectrum


 

Automated VerifyIt Proton Assignments:

Proton Assignments
 

Automated VerifyIt Carbon Assignments:

Carbon Assignments

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

The correct structure is at position 1.

FindIt Structures

 Best 10 structures in decreasing rating (structure ID shown in parentheses):
    1: 0.977191 (    2537)    2: 0.976225 (  565572)    3: 0.976164 (  565267)
    4: 0.975813 (  565598)    5: 0.973308 (   11027)    6: 0.972850 (  376006)
    7: 0.972680 (   25132)    8: 0.972546 (   86707)    9: 0.972140 (10534863)
   10: 0.971754 (11789398)
			

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

The correct structure is at position 1.

FindIt Structures

 Best 10 structures in decreasing rating (structure ID shown in parentheses):
    1: 0.960568 (    2537)    2: 0.912755 (   25132)    3: 0.910919 (   14525)
    4: 0.905379 (  220606)    5: 0.904204 (   85945)    6: 0.902503 (  431662)
    7: 0.902503 ( 7140194)    8: 0.901502 (11344683)    9: 0.900992 ( 1534835)
   10: 0.898050 ( 1753749)
			

Comments:

The correct structure is identified at the top FindIt place.


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