CID 105997

67893-04-3

Structural Information

Molecular Formula
C11H18O2
SMILES
CC(=C1CCC(CC1)(C)OC=O)C
InChI
InChI=1S/C11H18O2/c1-9(2)10-4-6-11(3,7-5-10)13-8-12/h8H,4-7H2,1-3H3
InChIKey
GGXHOOFNOCFIKQ-UHFFFAOYSA-N
Compound name
(1-methyl-4-propan-2-ylidenecyclohexyl) formate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.13068 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.13796 141.0
[M+Na]+ 205.11990 146.7
[M-H]- 181.12340 144.1
[M+NH4]+ 200.16450 163.0
[M+K]+ 221.09384 145.7
[M+H-H2O]+ 165.12794 136.4
[M+HCOO]- 227.12888 160.5
[M+CH3COO]- 241.14453 181.6
[M+Na-2H]- 203.10535 144.6
[M]+ 182.13013 138.9
[M]- 182.13123 138.9
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

No patent data available for this compound.