CID 13352200

88786-09-8

Structural Information

Molecular Formula
C10H14N2O
SMILES
CC1=NOC(=C1C2=CCCCC2)N
InChI
InChI=1S/C10H14N2O/c1-7-9(10(11)13-12-7)8-5-3-2-4-6-8/h5H,2-4,6,11H2,1H3
InChIKey
HSGVZNCMBXGDTD-UHFFFAOYSA-N
Compound name
4-(cyclohexen-1-yl)-3-methyl-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

178.11061 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.117886 138.3
[M+Na]+ 201.099828 145.7
[M-H]- 177.103334 144.0
[M+NH4]+ 196.144433 157.1
[M+K]+ 217.073768 144.2
[M+H-H2O]+ 161.107870 131.3
[M+HCOO]- 223.108811 160.4
[M+CH3COO]- 237.124461 181.6
[M+Na-2H]- 199.085276 142.7
[M]+ 178.11006142 135.5
[M]- 178.11115858 135.5
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