CID 137964206

(2e)-1,1,1-trifluoro-4,4-dimethoxypent-2-ene

Structural Information

Molecular Formula
C7H11F3O2
SMILES
CC(/C=C/C(F)(F)F)(OC)OC
InChI
InChI=1S/C7H11F3O2/c1-6(11-2,12-3)4-5-7(8,9)10/h4-5H,1-3H3/b5-4+
InChIKey
OVKBRBNMHZMHNH-SNAWJCMRSA-N
Compound name
(E)-1,1,1-trifluoro-4,4-dimethoxypent-2-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.07112 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.07840 135.4
[M+Na]+ 207.06034 143.7
[M-H]- 183.06384 132.1
[M+NH4]+ 202.10494 155.6
[M+K]+ 223.03428 143.1
[M+H-H2O]+ 167.06838 129.2
[M+HCOO]- 229.06932 153.3
[M+CH3COO]- 243.08497 181.0
[M+Na-2H]- 205.04579 141.8
[M]+ 184.07057 134.4
[M]- 184.07167 134.4
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

No patent data available for this compound.