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]+ 141.10224 128.4
[M+Na]+ 163.08418 137.7
[M-H]- 139.08768 134.9
[M+NH4]+ 158.12878 143.9
[M+K]+ 179.05812 136.2
[M+H-H2O]+ 123.09222 121.6
[M+HCOO]- 185.09316 151.4
[M+CH3COO]- 199.10881 177.7
[M+Na-2H]- 161.06963 134.3
[M]+ 140.09441 129.3
[M]- 140.09551 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.