CID 139026474

2361610-33-3

Structural Information

Molecular Formula
C11H17N3O
SMILES
CC(C)C1=NN=C(O1)[C@]23CC[C@H]2CCN3
InChI
InChI=1S/C11H17N3O/c1-7(2)9-13-14-10(15-9)11-5-3-8(11)4-6-12-11/h7-8,12H,3-6H2,1-2H3/t8-,11-/m0/s1
InChIKey
JTFICERTBALDEF-KWQFWETISA-N
Compound name
2-[(1S,5S)-2-azabicyclo[3.2.0]heptan-1-yl]-5-propan-2-yl-1,3,4-oxadiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.13716 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.14444 144.3
[M+Na]+ 230.12638 150.2
[M-H]- 206.12988 147.2
[M+NH4]+ 225.17098 157.2
[M+K]+ 246.10032 151.7
[M+H-H2O]+ 190.13442 133.0
[M+HCOO]- 252.13536 159.4
[M+CH3COO]- 266.15101 155.6
[M+Na-2H]- 228.11183 146.8
[M]+ 207.13661 151.3
[M]- 207.13771 151.3
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.