CID 136614

771-10-8

Structural Information

Molecular Formula
C10H18O2
SMILES
CCOC(=O)C1C(C1(C)C)(C)C
InChI
InChI=1S/C10H18O2/c1-6-12-8(11)7-9(2,3)10(7,4)5/h7H,6H2,1-5H3
InChIKey
JGWIOJNKGNJJLE-UHFFFAOYSA-N
Compound name
ethyl 2,2,3,3-tetramethylcyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

170.13068 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.137956 136.5
[M+Na]+ 193.119898 147.2
[M-H]- 169.123404 142.2
[M+NH4]+ 188.164503 156.7
[M+K]+ 209.093838 147.2
[M+H-H2O]+ 153.127940 133.8
[M+HCOO]- 215.128881 158.2
[M+CH3COO]- 229.144531 185.7
[M+Na-2H]- 191.105346 142.2
[M]+ 170.13013142 143.6
[M]- 170.13122858 143.6
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