CID 22336781

73275-63-5

Structural Information

Molecular Formula
C11H16O3
SMILES
CCOC(=O)OCC1CC2CC1C=C2
InChI
InChI=1S/C11H16O3/c1-2-13-11(12)14-7-10-6-8-3-4-9(10)5-8/h3-4,8-10H,2,5-7H2,1H3
InChIKey
BJVMGUDDQUGAQW-UHFFFAOYSA-N
Compound name
2-bicyclo[2.2.1]hept-5-enylmethyl ethyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
Patents

196.10994 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.11722 146.3
[M+Na]+ 219.09916 153.2
[M-H]- 195.10266 149.1
[M+NH4]+ 214.14376 170.9
[M+K]+ 235.07310 152.2
[M+H-H2O]+ 179.10720 141.9
[M+HCOO]- 241.10814 168.2
[M+CH3COO]- 255.12379 183.0
[M+Na-2H]- 217.08461 148.8
[M]+ 196.10939 149.4
[M]- 196.11049 149.4
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