CID 6434212

Brn 2877016

Structural Information

Molecular Formula
C20H27NO2
SMILES
CC1C2CCC(C2)C1CN(CCO)C(=O)/C=C/C3=CC=CC=C3
InChI
InChI=1S/C20H27NO2/c1-15-17-8-9-18(13-17)19(15)14-21(11-12-22)20(23)10-7-16-5-3-2-4-6-16/h2-7,10,15,17-19,22H,8-9,11-14H2,1H3/b10-7+
InChIKey
PMVYKYDAFDPIFY-JXMROGBWSA-N
Compound name
(E)-N-(2-hydroxyethyl)-N-[(3-methyl-2-bicyclo[2.2.1]heptanyl)methyl]-3-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.2042 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.21148 178.7
[M+Na]+ 336.19342 186.3
[M+NH4]+ 331.23802 186.5
[M+K]+ 352.16736 183.1
[M-H]- 312.19692 180.8
[M+Na-2H]- 334.17887 180.2
[M]+ 313.20365 180.0
[M]- 313.20475 180.0
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.