CID 9588228

Brn 1448869

Structural Information

Molecular Formula
C10H12N2O
SMILES
CC1=NC(=CC=C1)/C=N/OCC=C
InChI
InChI=1S/C10H12N2O/c1-3-7-13-11-8-10-6-4-5-9(2)12-10/h3-6,8H,1,7H2,2H3/b11-8+
InChIKey
MQMWEVBWFGVBBL-DHZHZOJOSA-N
Compound name
(E)-1-(6-methylpyridin-2-yl)-N-prop-2-enoxymethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.09496 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.10224 136.9
[M+Na]+ 199.08418 145.0
[M-H]- 175.08768 140.5
[M+NH4]+ 194.12878 156.4
[M+K]+ 215.05812 143.0
[M+H-H2O]+ 159.09222 129.7
[M+HCOO]- 221.09316 163.0
[M+CH3COO]- 235.10881 185.2
[M+Na-2H]- 197.06963 144.8
[M]+ 176.09441 139.2
[M]- 176.09551 139.2
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.