CID 39870025

1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H11N3O
SMILES
CC1=NC(=NO1)C2(CCC2)N
InChI
InChI=1S/C7H11N3O/c1-5-9-6(10-11-5)7(8)3-2-4-7/h2-4,8H2,1H3
InChIKey
SHJPGPOPDVKKDN-UHFFFAOYSA-N
Compound name
1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

153.09021 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.097486 127.8
[M+Na]+ 176.079428 135.0
[M-H]- 152.082934 132.4
[M+NH4]+ 171.124033 141.7
[M+K]+ 192.053368 137.7
[M+H-H2O]+ 136.087470 116.4
[M+HCOO]- 198.088411 149.0
[M+CH3COO]- 212.104061 179.2
[M+Na-2H]- 174.064876 134.7
[M]+ 153.08966142 135.4
[M]- 153.09075858 135.4
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