CID 3797190

80783-99-9

Structural Information

Molecular Formula
C11H13NO2
SMILES
CN(C(=O)C=CC1=CC=CC=C1)OC
InChI
InChI=1S/C11H13NO2/c1-12(14-2)11(13)9-8-10-6-4-3-5-7-10/h3-9H,1-2H3
InChIKey
PUWLTCZZUOAVPD-UHFFFAOYSA-N
Compound name
N-methoxy-N-methyl-3-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

191.09464 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.10192 141.8
[M+Na]+ 214.08386 148.1
[M-H]- 190.08736 146.7
[M+NH4]+ 209.12846 161.6
[M+K]+ 230.05780 147.4
[M+H-H2O]+ 174.09190 135.2
[M+HCOO]- 236.09284 167.2
[M+CH3COO]- 250.10849 187.5
[M+Na-2H]- 212.06931 147.3
[M]+ 191.09409 143.7
[M]- 191.09519 143.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe