Mrv0541 09231411012D          

 16 15  0  0  0  0            999 V2000
    7.3597  -13.4687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0741  -13.0563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7887  -13.4687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5031  -13.0563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2176  -13.4687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9321  -13.0563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6465  -13.4687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3610  -13.0563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0755  -13.4687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6452  -13.0563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3597  -14.2937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7900  -13.0563    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5044  -13.4687    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.0920  -14.1832    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9170  -12.7543    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2189  -13.8813    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  3  4  1  0  0  0  0
  6  7  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  2  0  0  0  0
 13 16  1  0  0  0  0
 12  9  1  0  0  0  0
M  END
> <ID>
CHEBI:83090

> <NAME>
(9-methyldecyl)sulfamic acid

> <DEFINITION>
A member of the class of sulfamic acids that is sulfamic acid in which one of the amino hydrogens has been replaced by a (9-methyldecyl) group.

> <STAR>
3

> <IUPAC_NAME>
(9-methyldecyl)sulfamic acid

> <FORMULA>
C11H25NO3S

> <MASS>
251.38600

> <MONOISOTOPIC_MASS>
251.15551

> <CHARGE>
0

> <SMILES>
CC(C)CCCCCCCCNS(O)(=O)=O

> <INCHI>
InChI=1S/C11H25NO3S/c1-11(2)9-7-5-3-4-6-8-10-12-16(13,14)15/h11-12H,3-10H2,1-2H3,(H,13,14,15)

> <INCHIKEY>
GAYAKNYWWOBJHZ-UHFFFAOYSA-N

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