CID 294151

101832-33-1

Structural Information

Molecular Formula

C₁₀H₁₆N₂O

SMILES

C1CC2CC1CC2NC3=NCCO3

InChI

InChI=1S/C10H16N2O/c1-2-8-5-7(1)6-9(8)12-10-11-3-4-13-10/h7-9H,1-6H2,(H,11,12)

InChIKey

UBJQGXKAUYCWBB-UHFFFAOYSA-N

Compound name

N-(2-bicyclo[2.2.1]heptanyl)-4,5-dihydro-1,3-oxazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 33
Patents: 180.12627 Da
Monoisotopic Mass: 1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	181.13355	139.0
[M+Na]+	203.11549	144.7
[M-H]-	179.11899	144.1
[M+NH4]+	198.16009	162.6
[M+K]+	219.08943	144.2
[M+H-H2O]+	163.12353	133.5
[M+HCOO]-	225.12447	159.9
[M+CH3COO]-	239.14012	152.0
[M+Na-2H]-	201.10094	141.8
[M]+	180.12572	136.4
[M]-	180.12682	136.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe