CID 24912

Enpromate

Structural Information

Molecular Formula
C22H23NO2
SMILES
C#CC(C1=CC=CC=C1)(C2=CC=CC=C2)OC(=O)NC3CCCCC3
InChI
InChI=1S/C22H23NO2/c1-2-22(18-12-6-3-7-13-18,19-14-8-4-9-15-19)25-21(24)23-20-16-10-5-11-17-20/h1,3-4,6-9,12-15,20H,5,10-11,16-17H2,(H,23,24)
InChIKey
NBEALWAVEGMZQY-UHFFFAOYSA-N
Compound name
1,1-diphenylprop-2-ynyl N-cyclohexylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13438
Patents

333.17288 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.18016 187.5
[M+Na]+ 356.16210 198.9
[M+NH4]+ 351.20670 191.7
[M+K]+ 372.13604 187.7
[M-H]- 332.16560 184.9
[M+Na-2H]- 354.14755 192.7
[M]+ 333.17233 187.6
[M]- 333.17343 187.6
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

patents stripe