CID 9588818

Brn 5814771

Structural Information

Molecular Formula
C10H17N3O3
SMILES
CCNC(=O)ON1CCC=C(C1)/C=N/OC
InChI
InChI=1S/C10H17N3O3/c1-3-11-10(14)16-13-6-4-5-9(8-13)7-12-15-2/h5,7H,3-4,6,8H2,1-2H3,(H,11,14)/b12-7+
InChIKey
BFLSHVDLBFOOJM-KPKJPENVSA-N
Compound name
[5-[(E)-methoxyiminomethyl]-3,6-dihydro-2H-pyridin-1-yl] N-ethylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.127 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.13428 150.5
[M+Na]+ 250.11622 155.3
[M-H]- 226.11972 153.4
[M+NH4]+ 245.16082 167.2
[M+K]+ 266.09016 155.2
[M+H-H2O]+ 210.12426 142.5
[M+HCOO]- 272.12520 174.2
[M+CH3COO]- 286.14085 194.6
[M+Na-2H]- 248.10167 155.5
[M]+ 227.12645 151.2
[M]- 227.12755 151.2
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.