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CAS Number: 13697-84-2
1-methoxy-5-methylcyclohexa-1,4-diene

Structure

1-methoxy-5-methylcyclohexa-1,4-diene
Name: 1-methoxy-5-methylcyclohexa-1,4-diene
Synonyms:
General Information
Product Number: 13697842
CAS Registry Number: 13697-84-2
Name:
1,​4-​Cyclohexadiene, 1-​methoxy-​5-​methyl-
Ether, methyl 5-​methyl-​1,​4-​cyclohexadien-​1-​yl (7CI,​8CI); 1-​Methoxy-​5-​methyl-​1,​4-​cyclohexadiene; 2-​Methyl-​4-​methoxy-​1,​4-​cyclohexadiene 
 
Chemical Formula: C8H12O
Exact Mass: 124.09
Molecular Weight: 124.18
m/z: 124.09 (100.0%), 125.09 (8.7%)
Elemental Analysis: C, 77.38; H, 9.74; O, 12.88
 
InChI: InChI=1S/C8H12O/c1-7-4-3-5-8(6-7)9-2/h4-5H,3,6H2,1-2H3
InChIKey: JHXCCDQIOYRZIM-UHFFFAOYSA-N
Canonical SMILES : CC1=CCC=C(C1)OC

Specification

98%

References
  1. (1) ACD: Spectral data were obtained from Advanced Chemistry Development, Inc.
  2. (2) Kanakam, Charles C.; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) 1989, (11), P1907-13 CAPLUS
  3. (3) Biju, Purakkattle. J.; ARKIVOC (Gainesville, FL, United States) 2004, (8), P37-45 CAPLUS
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