CID 106939

67874-82-2

Structural Information

Molecular Formula
C16H24O2
SMILES
CC1(CC(C=C2C13CCC(C3)C2(C)C)OC=O)C
InChI
InChI=1S/C16H24O2/c1-14(2)9-12(18-10-17)7-13-15(3,4)11-5-6-16(13,14)8-11/h7,10-12H,5-6,8-9H2,1-4H3
InChIKey
WJZMQDGXHGRQSQ-UHFFFAOYSA-N
Compound name
(2,2,7,7-tetramethyl-4-tricyclo[6.2.1.01,6]undec-5-enyl) formate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

248.17763 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.18491 158.2
[M+Na]+ 271.16685 167.3
[M-H]- 247.17035 162.9
[M+NH4]+ 266.21145 187.6
[M+K]+ 287.14079 163.2
[M+H-H2O]+ 231.17489 154.7
[M+HCOO]- 293.17583 176.3
[M+CH3COO]- 307.19148 196.0
[M+Na-2H]- 269.15230 161.8
[M]+ 248.17708 160.0
[M]- 248.17818 160.0
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