CID 5365699

67633-96-9

Structural Information

Molecular Formula
C8H14O3
SMILES
CC/C=C\CCOC(=O)OC
InChI
InChI=1S/C8H14O3/c1-3-4-5-6-7-11-8(9)10-2/h4-5H,3,6-7H2,1-2H3/b5-4-
InChIKey
BLOXMGXSDAAJGX-PLNGDYQASA-N
Compound name
[(Z)-hex-3-enyl] methyl carbonate
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

1392
Patents

158.0943 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.10158 134.7
[M+Na]+ 181.08352 141.7
[M-H]- 157.08702 134.9
[M+NH4]+ 176.12812 155.9
[M+K]+ 197.05746 141.7
[M+H-H2O]+ 141.09156 129.9
[M+HCOO]- 203.09250 158.1
[M+CH3COO]- 217.10815 176.2
[M+Na-2H]- 179.06897 139.6
[M]+ 158.09375 138.9
[M]- 158.09485 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

patents stripe