CID 10583

1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Structural Information

Molecular Formula
C15H24
SMILES
CC(=C)C1CCC(C(C1)C(=C)C)(C)C=C
InChI
InChI=1S/C15H24/c1-7-15(6)9-8-13(11(2)3)10-14(15)12(4)5/h7,13-14H,1-2,4,8-10H2,3,5-6H3
InChIKey
OPFTUNCRGUEPRZ-UHFFFAOYSA-N
Compound name
1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

428
References

21354
Patents

204.1878 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.19508 148.3
[M+Na]+ 227.17702 153.4
[M-H]- 203.18052 151.2
[M+NH4]+ 222.22162 169.7
[M+K]+ 243.15096 150.2
[M+H-H2O]+ 187.18506 144.0
[M+HCOO]- 249.18600 165.2
[M+CH3COO]- 263.20165 191.6
[M+Na-2H]- 225.16247 148.1
[M]+ 204.18725 143.8
[M]- 204.18835 143.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe