CID 3075651

Loline, 5,6-dehydro-n-acetyl-

Structural Information

Molecular Formula
C10H14N2O2
SMILES
CC(=O)N(C)[C@@H]1[C@H]2CN3[C@@H]1[C@@H](O2)C=C3
InChI
InChI=1S/C10H14N2O2/c1-6(13)11(2)9-8-5-12-4-3-7(14-8)10(9)12/h3-4,7-10H,5H2,1-2H3/t7-,8+,9+,10+/m0/s1
InChIKey
RWZPZYGWKYFABR-SGIHWFKDSA-N
Compound name
N-methyl-N-[(1R,3S,7S,8S)-2-oxa-6-azatricyclo[4.2.1.03,7]non-4-en-8-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.10553 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.11281 144.0
[M+Na]+ 217.09475 151.5
[M-H]- 193.09825 148.3
[M+NH4]+ 212.13935 169.3
[M+K]+ 233.06869 152.3
[M+H-H2O]+ 177.10279 139.9
[M+HCOO]- 239.10373 164.4
[M+CH3COO]- 253.11938 190.5
[M+Na-2H]- 215.08020 146.3
[M]+ 194.10498 147.5
[M]- 194.10608 147.5
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

No patent data available for this compound.