CID 56965657

1159737-11-7

Structural Information

Molecular Formula
C6H9N3O
SMILES
CC1=NOC(=N1)C2(CC2)N
InChI
InChI=1S/C6H9N3O/c1-4-8-5(10-9-4)6(7)2-3-6/h2-3,7H2,1H3
InChIKey
FMHSWVAWPDYUJH-UHFFFAOYSA-N
Compound name
1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

139.07455 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.081826 129.8
[M+Na]+ 162.063768 141.3
[M-H]- 138.067274 135.7
[M+NH4]+ 157.108373 146.0
[M+K]+ 178.037708 140.2
[M+H-H2O]+ 122.071810 123.3
[M+HCOO]- 184.072751 153.0
[M+CH3COO]- 198.088401 144.0
[M+Na-2H]- 160.049216 137.6
[M]+ 139.07400142 132.5
[M]- 139.07509858 132.5
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