CID 71310521

1217461-20-5

Structural Information

Molecular Formula
C22H25NO3
SMILES
C1CC[C@@H]([C@H](C1)CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)O
InChI
InChI=1S/C22H25NO3/c24-21-12-6-1-7-15(21)13-23-22(25)26-14-20-18-10-4-2-8-16(18)17-9-3-5-11-19(17)20/h2-5,8-11,15,20-21,24H,1,6-7,12-14H2,(H,23,25)/t15-,21+/m1/s1
InChIKey
DLDUSAROVXDNNQ-VFNWGFHPSA-N
Compound name
9H-fluoren-9-ylmethyl N-[[(1R,2S)-2-hydroxycyclohexyl]methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.18344 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.19072 185.2
[M+Na]+ 374.17266 196.2
[M+NH4]+ 369.21726 193.7
[M+K]+ 390.14660 190.0
[M-H]- 350.17616 189.9
[M+Na-2H]- 372.15811 189.7
[M]+ 351.18289 187.9
[M]- 351.18399 187.9
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.