CID 13740695

1,1,3,3-tetramethyl-5-methylenecyclohexane

Structural Information

Molecular Formula
C11H20
SMILES
CC1(CC(=C)CC(C1)(C)C)C
InChI
InChI=1S/C11H20/c1-9-6-10(2,3)8-11(4,5)7-9/h1,6-8H2,2-5H3
InChIKey
LOZBJRFLBQGRJF-UHFFFAOYSA-N
Compound name
1,1,3,3-tetramethyl-5-methylidenecyclohexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

152.1565 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.16378 131.7
[M+Na]+ 175.14572 139.3
[M-H]- 151.14922 135.7
[M+NH4]+ 170.19032 157.5
[M+K]+ 191.11966 137.8
[M+H-H2O]+ 135.15376 128.5
[M+HCOO]- 197.15470 151.6
[M+CH3COO]- 211.17035 179.3
[M+Na-2H]- 173.13117 137.2
[M]+ 152.15595 128.8
[M]- 152.15705 128.8
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