CID 82417091

3-methyl-5-(pyrrolidin-3-yl)-1,2-oxazole hydrochloride

Structural Information

Molecular Formula
C8H12N2O
SMILES
CC1=NOC(=C1)C2CCNC2
InChI
InChI=1S/C8H12N2O/c1-6-4-8(11-10-6)7-2-3-9-5-7/h4,7,9H,2-3,5H2,1H3
InChIKey
UWQBOXVVGPLCRA-UHFFFAOYSA-N
Compound name
3-methyl-5-pyrrolidin-3-yl-1,2-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.09496 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.10224 131.4
[M+Na]+ 175.08418 138.8
[M-H]- 151.08768 134.7
[M+NH4]+ 170.12878 151.2
[M+K]+ 191.05812 138.0
[M+H-H2O]+ 135.09222 124.6
[M+HCOO]- 197.09316 151.6
[M+CH3COO]- 211.10881 144.7
[M+Na-2H]- 173.06963 134.9
[M]+ 152.09441 128.6
[M]- 152.09551 128.6
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

No patent data available for this compound.