CID 10313164

1,1-dimethyl-2,3-dimethylidenecyclohexane

Structural Information

Molecular Formula
C10H16
SMILES
CC1(CCCC(=C)C1=C)C
InChI
InChI=1S/C10H16/c1-8-6-5-7-10(3,4)9(8)2/h1-2,5-7H2,3-4H3
InChIKey
DUNVVCSHCNSQOY-UHFFFAOYSA-N
Compound name
1,1-dimethyl-2,3-dimethylidenecyclohexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

136.1252 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.13248 127.9
[M+Na]+ 159.11442 135.2
[M-H]- 135.11792 131.5
[M+NH4]+ 154.15902 152.1
[M+K]+ 175.08836 133.0
[M+H-H2O]+ 119.12246 124.0
[M+HCOO]- 181.12340 148.2
[M+CH3COO]- 195.13905 175.6
[M+Na-2H]- 157.09987 132.7
[M]+ 136.12465 123.5
[M]- 136.12575 123.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe