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

19
Patents

178.11061 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.11789 138.3
[M+Na]+ 201.09983 145.7
[M-H]- 177.10333 144.0
[M+NH4]+ 196.14443 157.1
[M+K]+ 217.07377 144.2
[M+H-H2O]+ 161.10787 131.3
[M+HCOO]- 223.10881 160.4
[M+CH3COO]- 237.12446 181.6
[M+Na-2H]- 199.08528 142.7
[M]+ 178.11006 135.5
[M]- 178.11116 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