CID 3033188

60548-47-2

Structural Information

Molecular Formula
C15H19NO2
SMILES
C/C(=C(\C)/C(=O)NC1CC1)/C2=CC=C(C=C2)OC
InChI
InChI=1S/C15H19NO2/c1-10(11(2)15(17)16-13-6-7-13)12-4-8-14(18-3)9-5-12/h4-5,8-9,13H,6-7H2,1-3H3,(H,16,17)/b11-10-
InChIKey
NJCVMQUEWFSPQQ-KHPPLWFESA-N
Compound name
(Z)-N-cyclopropyl-3-(4-methoxyphenyl)-2-methylbut-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

245.14159 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.14887 154.1
[M+Na]+ 268.13081 160.8
[M-H]- 244.13431 161.3
[M+NH4]+ 263.17541 166.4
[M+K]+ 284.10475 157.6
[M+H-H2O]+ 228.13885 147.1
[M+HCOO]- 290.13979 176.3
[M+CH3COO]- 304.15544 200.0
[M+Na-2H]- 266.11626 156.0
[M]+ 245.14104 156.5
[M]- 245.14214 156.5
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

No patent data available for this compound.