COMPOUND: C17782
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Entry
C17782 Compound
Name
3,5-Dimethoxyallylbenzene
Formula
C11H14O2
Exact mass
178.0994
Mol weight
178.2277
Structure
Mol file
KCF file
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Other DBs
PubChem:
96024101
ChEBI:
81334
NIKKAJI:
J920.069J
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KCF data
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ATOM 13
1 C8y C 18.9000 -21.6300
2 C8x C 18.9000 -23.0300
3 C8y C 20.1124 -23.7300
4 C8x C 21.3249 -23.0300
5 C8y C 21.3249 -21.6300
6 C8x C 20.1124 -20.9300
7 C1b C 22.5560 -20.9190
8 C2b C 23.7612 -21.6147
9 C2a C 24.9435 -20.9319
10 O2a O 17.6876 -20.9300
11 C1a C 16.4921 -21.6204
12 O2a O 20.1124 -25.1298
13 C1a C 21.3248 -25.8298
BOND 13
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 5 7 1
8 7 8 1
9 8 9 2
10 1 10 1
11 10 11 1
12 3 12 1
13 12 13 1
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