COMPOUND: C19417
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Entry
C19417 Compound
Name
3,4-Epoxy-6-methylcyclohexylmethyl-3,4-epoxy-6-methylcyclo-hexanecarboxylate
Formula
C16H24O4
Exact mass
280.1675
Mol weight
280.36
Structure
Mol file
KCF file
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CAS:
141-37-7
PubChem:
124490089
ChEBI:
82463
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KCF data
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ATOM 20
1 C1x C 15.4700 -17.7800
2 C1y C 15.4700 -19.1800
3 C1y C 16.6824 -19.8800
4 C1x C 17.8949 -19.1800
5 C1y C 17.8949 -17.7800
6 C1y C 16.6824 -17.0800
7 C1b C 19.1324 -17.0800
8 O7a O 20.3449 -17.7800
9 C7a C 21.5573 -17.0800
10 C1y C 22.7697 -17.7800
11 C1y C 22.7697 -19.1799
12 C1x C 23.9822 -19.8799
13 C1y C 25.1946 -19.1799
14 C1y C 25.1946 -17.7800
15 C1x C 23.9822 -17.0800
16 C1a C 16.6824 -15.6802
17 O2x O 15.4700 -20.5800
18 O6a O 21.5573 -15.6800
19 C1a C 21.5425 -19.8885
20 O2x O 26.4070 -18.4800
BOND 23
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 10 15 1
17 6 16 1
18 2 17 1
19 3 17 1
20 9 18 2
21 11 19 1
22 14 20 1
23 13 20 1
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