KEGG   COMPOUND: C14323
Entry
C14323                      Compound                               
Name
Butylate;
Sutan;
S-Ethyl N,N-diisobutylthiocarbamate
Formula
C11H23NOS
Exact mass
217.1500
Mol weight
217.37
Structure
Other DBs
CAS: 2008-41-5
PubChem: 17395323
ChEBI: 34594
NIKKAJI: J7.846H
LinkDB
KCF data

ATOM        14
            1   C1a C    24.1455  -16.6222
            2   C1c C    25.3577  -17.3201
            3   C1b C    26.5703  -16.6222
            4   N1c N    27.7827  -17.3201
            5   C5a C    28.9880  -16.6222
            6   S2a S    30.2003  -17.3201
            7   C1b C    31.4127  -16.6222
            8   C1a C    32.6253  -17.3201
            9   O5a O    28.9880  -15.2197
            10  C1b C    27.7827  -18.7228
            11  C1a C    25.3583  -18.7462
            12  C1c C    28.9995  -19.4252
            13  C1a C    30.1761  -18.7457
            14  C1a C    29.0001  -20.8437
BOND        13
            1     6   7 1
            2     3   4 1
            3     7   8 1
            4     5   9 2
            5     4   5 1
            6     4  10 1
            7     2   3 1
            8     5   6 1
            9     1   2 1
            10    2  11 1
            11   10  12 1
            12   12  13 1
            13   12  14 1

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