CID 64166812

2649068-08-4

Structural Information

Molecular Formula
C7H12N2O
SMILES
C1CC1C2=NOC(C2)CN
InChI
InChI=1S/C7H12N2O/c8-4-6-3-7(9-10-6)5-1-2-5/h5-6H,1-4,8H2
InChIKey
DRPLXDIHSDKTFX-UHFFFAOYSA-N
Compound name
(3-cyclopropyl-4,5-dihydro-1,2-oxazol-5-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

140.09496 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.102236 128.4
[M+Na]+ 163.084178 137.7
[M-H]- 139.087684 134.9
[M+NH4]+ 158.128783 143.9
[M+K]+ 179.058118 136.2
[M+H-H2O]+ 123.092220 121.6
[M+HCOO]- 185.093161 151.4
[M+CH3COO]- 199.108811 177.7
[M+Na-2H]- 161.069626 134.3
[M]+ 140.09441142 129.3
[M]- 140.09550858 129.3
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.