CID 12148226

1-methoxycyclopentane-1-carbaldehyde

Structural Information

Molecular Formula
C7H12O2
SMILES
COC1(CCCC1)C=O
InChI
InChI=1S/C7H12O2/c1-9-7(6-8)4-2-3-5-7/h6H,2-5H2,1H3
InChIKey
GKVKYSSIHCDQOL-UHFFFAOYSA-N
Compound name
1-methoxycyclopentane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

128.08372 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.09100 127.5
[M+Na]+ 151.07294 137.2
[M+NH4]+ 146.11754 137.6
[M+K]+ 167.04688 131.4
[M-H]- 127.07644 128.4
[M+Na-2H]- 149.05839 133.5
[M]+ 128.08317 129.0
[M]- 128.08427 129.0
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