CID 23006353

893641-32-2

Structural Information

Molecular Formula
C7H12N2O
SMILES
CC1=C(C(=NO1)C)CNC
InChI
InChI=1S/C7H12N2O/c1-5-7(4-8-3)6(2)10-9-5/h8H,4H2,1-3H3
InChIKey
KUSBHINLXPYBKU-UHFFFAOYSA-N
Compound name
1-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

140.09496 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.10224 128.2
[M+Na]+ 163.08418 137.5
[M-H]- 139.08768 131.8
[M+NH4]+ 158.12878 149.4
[M+K]+ 179.05812 137.5
[M+H-H2O]+ 123.09222 122.3
[M+HCOO]- 185.09316 153.2
[M+CH3COO]- 199.10881 177.0
[M+Na-2H]- 161.06963 135.0
[M]+ 140.09441 130.6
[M]- 140.09551 130.6
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