CID 80461910

1477874-55-7

Structural Information

Molecular Formula
C7H10N2O2
SMILES
C1COCC2=C1ON=C2CN
InChI
InChI=1S/C7H10N2O2/c8-3-6-5-4-10-2-1-7(5)11-9-6/h1-4,8H2
InChIKey
KTHXXVUSVZVCAD-UHFFFAOYSA-N
Compound name
6,7-dihydro-4H-pyrano[3,4-d][1,2]oxazol-3-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.07423 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.08151 129.0
[M+Na]+ 177.06345 136.8
[M-H]- 153.06695 132.9
[M+NH4]+ 172.10805 148.4
[M+K]+ 193.03739 137.4
[M+H-H2O]+ 137.07149 123.0
[M+HCOO]- 199.07243 149.7
[M+CH3COO]- 213.08808 142.8
[M+Na-2H]- 175.04890 137.2
[M]+ 154.07368 128.2
[M]- 154.07478 128.2
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.