CID 65493648

2-[1-(methoxymethyl)cyclopropyl]acetonitrile

Structural Information

Molecular Formula
C7H11NO
SMILES
COCC1(CC1)CC#N
InChI
InChI=1S/C7H11NO/c1-9-6-7(2-3-7)4-5-8/h2-4,6H2,1H3
InChIKey
RIPKRDMUEIMKAP-UHFFFAOYSA-N
Compound name
2-[1-(methoxymethyl)cyclopropyl]acetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

125.08406 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.09134 122.2
[M+Na]+ 148.07328 137.8
[M-H]- 124.07678 129.1
[M+NH4]+ 143.11788 141.6
[M+K]+ 164.04722 133.6
[M+H-H2O]+ 108.08132 114.2
[M+HCOO]- 170.08226 144.5
[M+CH3COO]- 184.09791 187.8
[M+Na-2H]- 146.05873 132.1
[M]+ 125.08351 123.6
[M]- 125.08461 123.6
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